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

Systemtic Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-4-isopentyloxy-benzamide CAS Name: N-[[4-[ethyl(phenyl)sulfamoyl]anilino]-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: N-[[4-[ethyl(phenyl)sulfamoyl]phenyl]thiocarbamoyl]-4-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=C(C=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=C(C=C3)OCCC(C)C

InChI

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