Molecule ID: 3000579

IUPAC Name: (4-aminophenyl)sulfonylthiourea

Description: The molecule is a substituted aniline that is thiourea in which one of the hydrogens has been replaced by a (p-aminophenyl)sulfonyl group. It has a role as an antibacterial drug and an EC 2.5.1.15 (dihydropteroate synthase) inhibitor. It is a sulfonamide antibiotic, a member of thioureas and a substituted aniline. It derives from a sulfanilamide.

SMILES: N=C(S)NS(=O)(=O)c1ccc(N)cc1

SELFIES: [N][=C][Branch1][C][S][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1]

InChI: InChI=1S/C7H9N3O2S2/c8-5-1-3-6(4-2-5)14(11,12)10-7(9)13/h1-4H,8H2,(H3,9,10,13)

Molecular Properties:
- Polar Surface Area: 139.0 Ų
- LogP: -0.7