4-cyano-N-[5-[(3,4-dimethoxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-cyano-N-[5-[(3,4-dimethoxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-cyano-N-[5-[(3,4-dimethoxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-cyano-N-[5-[(3,4-dimethoxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-cyano-N-[5-[(3,4-dimethoxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-cyano-N-[5-(veratrylamino)-1,3,4-thiadiazol-2-yl]benzamide Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)C#N)OC

InChI

InChI=1S/C19H17N5O3S/c1-26-15-8-5-13(9-16(15)27-2)11-21-18-23-24-19(28-18)22-17(25)14-6-3-12(10-20)4-7-14/h3-9H,11H2,1-2H3,(H,21,23)(H,22,24,25)