N2-(3-chloranyl-1-benzothiophen-2-yl)-N1-(pyridin-3-ylmethyl)benzene-1,2-dicarboxamide

Systemtic Name: N2-(3-chloranyl-1-benzothiophen-2-yl)-N1-(pyridin-3-ylmethyl)benzene-1,2-dicarboxamide Openeye Name: N2-(3-chlorobenzothiophen-2-yl)-N1-(3-pyridylmethyl)phthalamide CAS Name: N2-(3-chloro-1-benzothiophen-2-yl)-N1-(3-pyridinylmethyl)benzene-1,2-dicarboxamide IUPAC Name: 2-N-(3-chloro-1-benzothiophen-2-yl)-1-N-(pyridin-3-ylmethyl)benzene-1,2-dicarboxamide Traditional Name: N'-(3-chlorobenzothiophen-2-yl)-N-(3-pyridylmethyl)phthalamide Formula: C22H16ClN3O2S MolecularWeight: 421.89934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)NC(=O)C3=CC=CC=C3C(=O)NCC4=CN=CC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)NC(=O)C3=CC=CC=C3C(=O)NCC4=CN=CC=C4)Cl

InChI

InChI=1S/C22H16ClN3O2S/c23-19-17-9-3-4-10-18(17)29-22(19)26-21(28)16-8-2-1-7-15(16)20(27)25-13-14-6-5-11-24-12-14/h1-12H,13H2,(H,25,27)(H,26,28)