N-(1-benzothiophen-2-ylmethyl)-6-methyl-4-oxidanylidene-2-phenethyl-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide

Systemtic Name: N-(1-benzothiophen-2-ylmethyl)-6-methyl-4-oxidanylidene-2-phenethyl-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide Openeye Name: N-(benzothiophen-2-ylmethyl)-6-methyl-4-oxo-2-phenethyl-1-(2-pyridylmethyl)pyridine-3-carboxamide CAS Name: N-(1-benzothiophen-2-ylmethyl)-6-methyl-4-oxo-2-phenethyl-1-(2-pyridinylmethyl)-3-pyridinecarboxamide IUPAC Name: N-(1-benzothiophen-2-ylmethyl)-6-methyl-4-oxo-2-phenethyl-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide Traditional Name: N-(benzothiophen-2-ylmethyl)-4-keto-6-methyl-2-phenethyl-1-(2-pyridylmethyl)nicotinamide Formula: C30H27N3O2S MolecularWeight: 493.61928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1CC2=CC=CC=N2)CCC3=CC=CC=C3)C(=O)NCC4=CC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC(=O)C(=C(N1CC2=CC=CC=N2)CCC3=CC=CC=C3)C(=O)NCC4=CC5=CC=CC=C5S4

InChI

InChI=1S/C30H27N3O2S/c1-21-17-27(34)29(30(35)32-19-25-18-23-11-5-6-13-28(23)36-25)26(15-14-22-9-3-2-4-10-22)33(21)20-24-12-7-8-16-31-24/h2-13,16-18H,14-15,19-20H2,1H3,(H,32,35)