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4-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylamino]-3-nitro-benzaldehyde

4-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylamino]-3-nitro-benzaldehyde

Systemtic Name:4-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylamino]-3-nitro-benzaldehyde
Openeye Name:4-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylamino]-3-nitro-benzaldehyde
CAS Name:4-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propylamino]-3-nitrobenzaldehyde
IUPAC Name:4-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylamino]-3-nitrobenzaldehyde
Traditional Name:4-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propylamino]-3-nitro-benzaldehyde
Formula: C18H23N5O3S
MolecularWeight: 389.47192
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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1C2CCCC2)CCCNC3=C(C=C(C=C3)C=O)[N+](=O)[O-]


Isomeric SMILES

CSC1=NN=C(N1C2CCCC2)CCCNC3=C(C=C(C=C3)C=O)[N+](=O)[O-]


InChI

InChI=1S/C18H23N5O3S/c1-27-18-21-20-17(22(18)14-5-2-3-6-14)7-4-10-19-15-9-8-13(12-24)11-16(15)23(25)26/h8-9,11-12,14,19H,2-7,10H2,1H3


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