1-(4-chlorophenyl)-5-propan-2-yl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-5-propan-2-yl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-(4-chlorophenyl)-5-isopropyl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)triazole-4-carboxamide CAS Name: 1-(4-chlorophenyl)-5-propan-2-yl-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]-4-triazolecarboxamide IUPAC Name: 1-(4-chlorophenyl)-5-propan-2-yl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)triazole-4-carboxamide Traditional Name: 1-(4-chlorophenyl)-5-isopropyl-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]triazole-4-carboxamide Formula: C17H19ClN6OS2 MolecularWeight: 422.95536

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)C2=C(N(N=N2)C3=CC=C(C=C3)Cl)C(C)C

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)C2=C(N(N=N2)C3=CC=C(C=C3)Cl)C(C)C

InChI

InChI=1S/C17H19ClN6OS2/c1-4-9-26-17-22-21-16(27-17)19-15(25)13-14(10(2)3)24(23-20-13)12-7-5-11(18)6-8-12/h5-8,10H,4,9H2,1-3H3,(H,19,21,25)