2-[(2,3-dimethoxyphenyl)methylamino]-N-(4-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[(2,3-dimethoxyphenyl)methylamino]-N-(4-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(2,3-dimethoxyphenyl)methylamino]-N-(4-methoxyphenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[(2,3-dimethoxyphenyl)methylamino]-N-(4-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(2,3-dimethoxyphenyl)methylamino]-N-(4-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(4-methoxyphenyl)-2-(o-veratrylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NCC4=C(C(=CC=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)NCC4=C(C(=CC=C4)OC)OC

InChI

InChI=1S/C25H28N2O4S/c1-29-18-13-11-17(12-14-18)27-24(28)22-19-8-4-5-10-21(19)32-25(22)26-15-16-7-6-9-20(30-2)23(16)31-3/h6-7,9,11-14,26H,4-5,8,10,15H2,1-3H3,(H,27,28)