2-methyl-4-(4-nitrophenyl)-5-(propylsulfanylmethyl)pyrazol-3-amine

Systemtic Name: 2-methyl-4-(4-nitrophenyl)-5-(propylsulfanylmethyl)pyrazol-3-amine Openeye Name: 2-methyl-4-(4-nitrophenyl)-5-(propylsulfanylmethyl)pyrazol-3-amine CAS Name: 2-methyl-4-(4-nitrophenyl)-5-[(propylthio)methyl]-3-pyrazolamine IUPAC Name: 2-methyl-4-(4-nitrophenyl)-5-(propylsulfanylmethyl)pyrazol-3-amine Traditional Name: [2-methyl-4-(4-nitrophenyl)-5-[(propylthio)methyl]pyrazol-3-yl]amine Formula: C14H18N4O2S MolecularWeight: 306.38332

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCC1=NN(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])N)C

Isomeric SMILES

CCCSCC1=NN(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])N)C

InChI

InChI=1S/C14H18N4O2S/c1-3-8-21-9-12-13(14(15)17(2)16-12)10-4-6-11(7-5-10)18(19)20/h4-7H,3,8-9,15H2,1-2H3