N-[3-[(3,4-dimethoxyphenyl)methylcarbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[3-[(3,4-dimethoxyphenyl)methylcarbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-3-carboxamide Openeye Name: N-[3-[(3,4-dimethoxyphenyl)methylcarbamoyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]pyridine-3-carboxamide CAS Name: N-[3-[[(3,4-dimethoxyphenyl)methylamino]-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[3-[(3,4-dimethoxyphenyl)methylcarbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-3-carboxamide Traditional Name: N-[3-(veratrylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]nicotinamide Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(SC3=C2CCCC3)NC(=O)C4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(SC3=C2CCCC3)NC(=O)C4=CN=CC=C4)OC

InChI

InChI=1S/C24H25N3O4S/c1-30-18-10-9-15(12-19(18)31-2)13-26-23(29)21-17-7-3-4-8-20(17)32-24(21)27-22(28)16-6-5-11-25-14-16/h5-6,9-12,14H,3-4,7-8,13H2,1-2H3,(H,26,29)(H,27,28)