1-(4-bromophenyl)-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]cyclopropane-1-carboxamide

Systemtic Name: 1-(4-bromophenyl)-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]cyclopropane-1-carboxamide Openeye Name: 1-(4-bromophenyl)-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]cyclopropanecarboxamide CAS Name: 1-(4-bromophenyl)-N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-1-cyclopropanecarboxamide IUPAC Name: 1-(4-bromophenyl)-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]cyclopropane-1-carboxamide Traditional Name: 1-(4-bromophenyl)-N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]cyclopropanecarboxamide Formula: C21H27BrN4OS MolecularWeight: 463.43428

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)C3(CC3)C4=CC=C(C=C4)Br

Isomeric SMILES

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)C3(CC3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H27BrN4OS/c1-28-20-25-24-18(26(20)17-5-2-3-6-17)7-4-14-23-19(27)21(12-13-21)15-8-10-16(22)11-9-15/h8-11,17H,2-7,12-14H2,1H3,(H,23,27)