N-(4-ethoxyphenyl)-2-(pyridin-4-ylmethylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide

Systemtic Name: N-(4-ethoxyphenyl)-2-(pyridin-4-ylmethylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Openeye Name: N-(4-ethoxyphenyl)-2-(4-pyridylmethylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide CAS Name: N-(4-ethoxyphenyl)-2-(pyridin-4-ylmethylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide IUPAC Name: N-(4-ethoxyphenyl)-2-(pyridin-4-ylmethylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Traditional Name: N-p-phenetyl-2-(4-pyridylmethylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCCC3)NCC4=CC=NC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCCC3)NCC4=CC=NC=C4

InChI

InChI=1S/C24H27N3O2S/c1-2-29-19-10-8-18(9-11-19)27-23(28)22-20-6-4-3-5-7-21(20)30-24(22)26-16-17-12-14-25-15-13-17/h8-15,26H,2-7,16H2,1H3,(H,27,28)