2-[2-(2-methoxyphenyl)ethanoylamino]-6-methyl-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-(2-methoxyphenyl)ethanoylamino]-6-methyl-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-(2-methoxyphenyl)acetyl]amino]-6-methyl-N-(3-pyridylmethyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(2-methoxyphenyl)-1-oxoethyl]amino]-6-methyl-N-(3-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-(2-methoxyphenyl)acetyl]amino]-6-methyl-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-(2-methoxyphenyl)acetyl]amino]-6-methyl-N-(3-pyridylmethyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)NCC3=CN=CC=C3)NC(=O)CC4=CC=CC=C4OC

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)NCC3=CN=CC=C3)NC(=O)CC4=CC=CC=C4OC

InChI

InChI=1S/C25H27N3O3S/c1-16-9-10-19-21(12-16)32-25(23(19)24(30)27-15-17-6-5-11-26-14-17)28-22(29)13-18-7-3-4-8-20(18)31-2/h3-8,11,14,16H,9-10,12-13,15H2,1-2H3,(H,27,30)(H,28,29)