N-(1,3-benzodioxol-5-ylmethyl)-2-[1-[(4-methylphenyl)methyl]indol-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-[(4-methylphenyl)methyl]indol-3-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(p-tolylmethyl)indol-3-yl]sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[1-[(4-methylphenyl)methyl]-3-indolyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-[(4-methylphenyl)methyl]indol-3-yl]sulfanylacetamide Traditional Name: 2-[[1-(4-methylbenzyl)indol-3-yl]thio]-N-piperonyl-acetamide Formula: C26H24N2O3S MolecularWeight: 444.54536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)SCC(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)SCC(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H24N2O3S/c1-18-6-8-19(9-7-18)14-28-15-25(21-4-2-3-5-22(21)28)32-16-26(29)27-13-20-10-11-23-24(12-20)31-17-30-23/h2-12,15H,13-14,16-17H2,1H3,(H,27,29)