3-methoxy-1-methyl-N-[5-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide

Systemtic Name: 3-methoxy-1-methyl-N-[5-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Openeye Name: 3-methoxy-1-methyl-N-[5-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide CAS Name: 3-methoxy-1-methyl-N-[5-[[2-(4-methylanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-4-pyrazolecarboxamide IUPAC Name: 3-methoxy-1-methyl-N-[5-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Traditional Name: N-[5-[[2-keto-2-(p-toluidino)ethyl]thio]-1,3,4-thiadiazol-2-yl]-3-methoxy-1-methyl-pyrazole-4-carboxamide Formula: C17H18N6O3S2 MolecularWeight: 418.49322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CN(N=C3OC)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CN(N=C3OC)C

InChI

InChI=1S/C17H18N6O3S2/c1-10-4-6-11(7-5-10)18-13(24)9-27-17-21-20-16(28-17)19-14(25)12-8-23(2)22-15(12)26-3/h4-8H,9H2,1-3H3,(H,18,24)(H,19,20,25)