N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-3-(2-methylpropoxy)benzamide

Systemtic Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-3-(2-methylpropoxy)benzamide Openeye Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-3-isobutoxy-benzamide CAS Name: N-[[4-[ethyl(phenyl)sulfamoyl]anilino]-sulfanylidenemethyl]-3-(2-methylpropoxy)benzamide IUPAC Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-3-(2-methylpropoxy)benzamide Traditional Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]thiocarbamoyl]-3-isobutoxy-benzamide Formula: C26H29N3O4S2 MolecularWeight: 511.65616

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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)OCC(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)OCC(C)C

InChI

InChI=1S/C26H29N3O4S2/c1-4-29(22-10-6-5-7-11-22)35(31,32)24-15-13-21(14-16-24)27-26(34)28-25(30)20-9-8-12-23(17-20)33-18-19(2)3/h5-17,19H,4,18H2,1-3H3,(H2,27,28,30,34)