N-(4-propan-2-yloxyphenyl)-2-(pyridin-4-ylmethylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(4-propan-2-yloxyphenyl)-2-(pyridin-4-ylmethylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(4-isopropoxyphenyl)-2-(4-pyridylmethylsulfanyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(4-propan-2-yloxyphenyl)-2-(pyridin-4-ylmethylthio)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(4-propan-2-yloxyphenyl)-2-(pyridin-4-ylmethylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(4-isopropoxyphenyl)-2-(4-pyridylmethylthio)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C24H26N2O2S2 MolecularWeight: 438.60544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)SCC4=CC=NC=C4

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)SCC4=CC=NC=C4

InChI

InChI=1S/C24H26N2O2S2/c1-16(2)28-19-9-7-18(8-10-19)26-23(27)22-20-5-3-4-6-21(20)30-24(22)29-15-17-11-13-25-14-12-17/h7-14,16H,3-6,15H2,1-2H3,(H,26,27)