4-chloranyl-6-[[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylamino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-6-[[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylamino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-6-[[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylamino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-6-[[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propylamino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-6-[[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylamino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-6-[[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propylamino]methylene]cyclohexa-2,4-dien-1-one Formula: C18H23ClN4OS MolecularWeight: 378.91942

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1C2CCCC2)CCCNC=C3C=C(C=CC3=O)Cl

Isomeric SMILES

CSC1=NN=C(N1C2CCCC2)CCCNC=C3C=C(C=CC3=O)Cl

InChI

InChI=1S/C18H23ClN4OS/c1-25-18-22-21-17(23(18)15-5-2-3-6-15)7-4-10-20-12-13-11-14(19)8-9-16(13)24/h8-9,11-12,15,20H,2-7,10H2,1H3