N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-3-(3-methylbutoxy)benzamide

Systemtic Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-3-(3-methylbutoxy)benzamide Openeye Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-3-isopentyloxy-benzamide CAS Name: N-[[4-[ethyl(phenyl)sulfamoyl]anilino]-sulfanylidenemethyl]-3-(3-methylbutoxy)benzamide IUPAC Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-3-(3-methylbutoxy)benzamide Traditional Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]thiocarbamoyl]-3-isoamoxy-benzamide Formula: C27H31N3O4S2 MolecularWeight: 525.68274

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCC(C)C

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCC(C)C

InChI

InChI=1S/C27H31N3O4S2/c1-4-30(23-10-6-5-7-11-23)36(32,33)25-15-13-22(14-16-25)28-27(35)29-26(31)21-9-8-12-24(19-21)34-18-17-20(2)3/h5-16,19-20H,4,17-18H2,1-3H3,(H2,28,29,31,35)