2-(1-benzofuran-2-ylmethylamino)-N-[4-ethyl-5-methyl-1-oxidanyl-2-(phenylmethyl)-6-sulfanyl-indol-3-yl]propanamide

Systemtic Name: 2-(1-benzofuran-2-ylmethylamino)-N-[4-ethyl-5-methyl-1-oxidanyl-2-(phenylmethyl)-6-sulfanyl-indol-3-yl]propanamide Openeye Name: 2-(benzofuran-2-ylmethylamino)-N-(2-benzyl-4-ethyl-1-hydroxy-5-methyl-6-sulfanyl-indol-3-yl)propanamide CAS Name: 2-(2-benzofuranylmethylamino)-N-[4-ethyl-1-hydroxy-6-mercapto-5-methyl-2-(phenylmethyl)-3-indolyl]propanamide IUPAC Name: 2-(1-benzofuran-2-ylmethylamino)-N-(2-benzyl-4-ethyl-1-hydroxy-5-methyl-6-sulfanylindol-3-yl)propanamide Traditional Name: 2-(benzofuran-2-ylmethylamino)-N-(2-benzyl-4-ethyl-1-hydroxy-6-mercapto-5-methyl-indol-3-yl)propionamide Formula: C30H31N3O3S MolecularWeight: 513.65044

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1C)S)N(C(=C2NC(=O)C(C)NCC3=CC4=CC=CC=C4O3)CC5=CC=CC=C5)O

Isomeric SMILES

CCC1=C2C(=CC(=C1C)S)N(C(=C2NC(=O)C(C)NCC3=CC4=CC=CC=C4O3)CC5=CC=CC=C5)O

InChI

InChI=1S/C30H31N3O3S/c1-4-23-18(2)27(37)16-24-28(23)29(25(33(24)35)14-20-10-6-5-7-11-20)32-30(34)19(3)31-17-22-15-21-12-8-9-13-26(21)36-22/h5-13,15-16,19,31,35,37H,4,14,17H2,1-3H3,(H,32,34)