N-(4-butylphenyl)-2-[1-(phenylmethyl)indol-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-butylphenyl)-2-[1-(phenylmethyl)indol-3-yl]sulfanyl-ethanamide Openeye Name: 2-(1-benzylindol-3-yl)sulfanyl-N-(4-butylphenyl)acetamide CAS Name: N-(4-butylphenyl)-2-[[1-(phenylmethyl)-3-indolyl]thio]acetamide IUPAC Name: 2-(1-benzylindol-3-yl)sulfanyl-N-(4-butylphenyl)acetamide Traditional Name: 2-[(1-benzylindol-3-yl)thio]-N-(4-butylphenyl)acetamide Formula: C27H28N2OS MolecularWeight: 428.58902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C27H28N2OS/c1-2-3-9-21-14-16-23(17-15-21)28-27(30)20-31-26-19-29(18-22-10-5-4-6-11-22)25-13-8-7-12-24(25)26/h4-8,10-17,19H,2-3,9,18,20H2,1H3,(H,28,30)