4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(2-ethylpyrazol-3-yl)benzamide

Systemtic Name: 4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(2-ethylpyrazol-3-yl)benzamide Openeye Name: 4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(2-ethylpyrazol-3-yl)benzamide CAS Name: 4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(2-ethyl-3-pyrazolyl)benzamide IUPAC Name: 4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(2-ethylpyrazol-3-yl)benzamide Traditional Name: 4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(2-ethylpyrazol-3-yl)benzamide Formula: C21H26N6OS MolecularWeight: 410.53574

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)NC(=O)C2=CC=C(C=C2)C3=NN(C(=NC4CCCCC4)S3)C

Isomeric SMILES

CCN1C(=CC=N1)NC(=O)C2=CC=C(C=C2)C3=NN(C(=NC4CCCCC4)S3)C

InChI

InChI=1S/C21H26N6OS/c1-3-27-18(13-14-22-27)24-19(28)15-9-11-16(12-10-15)20-25-26(2)21(29-20)23-17-7-5-4-6-8-17/h9-14,17H,3-8H2,1-2H3,(H,24,28)