N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)propionamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)NCCCC2=NC3=CC=CC=C3S2)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)NCCCC2=NC3=CC=CC=C3S2)C)C#N

InChI

InChI=1S/C21H22N4O2S/c1-13-15(14(2)24-21(27)16(13)12-22)9-10-19(26)23-11-5-8-20-25-17-6-3-4-7-18(17)28-20/h3-4,6-7H,5,8-11H2,1-2H3,(H,23,26)(H,24,27)