N-(2-benzamido-8-cyano-5-oxidanylidene-[1,3,4]thiadiazolo[3,2-a]pyridin-6-yl)benzamide

Systemtic Name: N-(2-benzamido-8-cyano-5-oxidanylidene-[1,3,4]thiadiazolo[3,2-a]pyridin-6-yl)benzamide Openeye Name: N-(2-benzamido-8-cyano-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyridin-6-yl)benzamide CAS Name: N-(2-benzamido-8-cyano-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyridin-6-yl)benzamide IUPAC Name: N-(2-benzamido-8-cyano-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyridin-6-yl)benzamide Traditional Name: N-(2-benzamido-8-cyano-5-keto-[1,3,4]thiadiazolo[3,2-a]pyridin-6-yl)benzamide Formula: C21H13N5O3S MolecularWeight: 415.42462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC(=C3N(C2=O)N=C(S3)NC(=O)C4=CC=CC=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC(=C3N(C2=O)N=C(S3)NC(=O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H13N5O3S/c22-12-15-11-16(23-17(27)13-7-3-1-4-8-13)19(29)26-20(15)30-21(25-26)24-18(28)14-9-5-2-6-10-14/h1-11H,(H,23,27)(H,24,25,28)