N-(3-pyrazol-1-ylphenyl)-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide

Systemtic Name: N-(3-pyrazol-1-ylphenyl)-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Openeye Name: N-(3-pyrazol-1-ylphenyl)-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide CAS Name: N-[3-(1-pyrazolyl)phenyl]-2-(1-pyrrolyl)-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide IUPAC Name: N-(3-pyrazol-1-ylphenyl)-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Traditional Name: N-(3-pyrazol-1-ylphenyl)-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Formula: C21H18N4OS2 MolecularWeight: 406.52382

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC2=C1C(=C(S2)N3C=CC=C3)C(=O)NC4=CC=CC(=C4)N5C=CC=N5

Isomeric SMILES

C1CSCC2=C1C(=C(S2)N3C=CC=C3)C(=O)NC4=CC=CC(=C4)N5C=CC=N5

InChI

InChI=1S/C21H18N4OS2/c26-20(23-15-5-3-6-16(13-15)25-11-4-8-22-25)19-17-7-12-27-14-18(17)28-21(19)24-9-1-2-10-24/h1-6,8-11,13H,7,12,14H2,(H,23,26)