4-(1,3-benzothiazol-2-yl)-N-[1-[(2-chlorophenyl)methyl]-6-oxidanylidene-pyridin-3-yl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[1-[(2-chlorophenyl)methyl]-6-oxidanylidene-pyridin-3-yl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[1-[(2-chlorophenyl)methyl]-6-oxo-3-pyridyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[1-[(2-chlorophenyl)methyl]-6-oxo-3-pyridinyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[1-[(2-chlorophenyl)methyl]-6-oxopyridin-3-yl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[1-(2-chlorobenzyl)-6-keto-3-pyridyl]butyramide Formula: C23H20ClN3O2S MolecularWeight: 437.9418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C=CC2=O)NC(=O)CCCC3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C=CC2=O)NC(=O)CCCC3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C23H20ClN3O2S/c24-18-7-2-1-6-16(18)14-27-15-17(12-13-23(27)29)25-21(28)10-5-11-22-26-19-8-3-4-9-20(19)30-22/h1-4,6-9,12-13,15H,5,10-11,14H2,(H,25,28)