2-[2-(3-methanoyl-2-methyl-indol-1-yl)ethanoylamino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-(3-methanoyl-2-methyl-indol-1-yl)ethanoylamino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-benzyl-2-[[2-(3-formyl-2-methyl-indol-1-yl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(3-formyl-2-methyl-1-indolyl)-1-oxoethyl]amino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-benzyl-2-[[2-(3-formyl-2-methylindol-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-benzyl-2-[[2-(3-formyl-2-methyl-indol-1-yl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC(=O)NC3=C(C4=C(S3)CCCC4)C(=O)NCC5=CC=CC=C5)C=O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC(=O)NC3=C(C4=C(S3)CCCC4)C(=O)NCC5=CC=CC=C5)C=O

InChI

InChI=1S/C28H27N3O3S/c1-18-22(17-32)20-11-5-7-13-23(20)31(18)16-25(33)30-28-26(21-12-6-8-14-24(21)35-28)27(34)29-15-19-9-3-2-4-10-19/h2-5,7,9-11,13,17H,6,8,12,14-16H2,1H3,(H,29,34)(H,30,33)