N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]-3-(3-methylbutoxy)benzamide

Systemtic Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]-3-(3-methylbutoxy)benzamide Openeye Name: N-[(4-indolin-1-ylsulfonylphenyl)carbamothioyl]-3-isopentyloxy-benzamide CAS Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)anilino]-sulfanylidenemethyl]-3-(3-methylbutoxy)benzamide IUPAC Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]-3-(3-methylbutoxy)benzamide Traditional Name: N-[(4-indolin-1-ylsulfonylphenyl)thiocarbamoyl]-3-isoamoxy-benzamide Formula: C27H29N3O4S2 MolecularWeight: 523.66686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C27H29N3O4S2/c1-19(2)15-17-34-23-8-5-7-21(18-23)26(31)29-27(35)28-22-10-12-24(13-11-22)36(32,33)30-16-14-20-6-3-4-9-25(20)30/h3-13,18-19H,14-17H2,1-2H3,(H2,28,29,31,35)