N-[(Z)-1-(3-methylsulfanyl-1,2,4-triazin-5-yl)propylideneamino]-4-nitro-aniline

Systemtic Name: N-[(Z)-1-(3-methylsulfanyl-1,2,4-triazin-5-yl)propylideneamino]-4-nitro-aniline Openeye Name: N-[(Z)-1-(3-methylsulfanyl-1,2,4-triazin-5-yl)propylideneamino]-4-nitro-aniline CAS Name: N-[(Z)-1-[3-(methylthio)-1,2,4-triazin-5-yl]propylideneamino]-4-nitroaniline IUPAC Name: N-[(Z)-1-(3-methylsulfanyl-1,2,4-triazin-5-yl)propylideneamino]-4-nitroaniline Traditional Name: [(Z)-1-[3-(methylthio)-1,2,4-triazin-5-yl]propylideneamino]-(4-nitrophenyl)amine Formula: C13H14N6O2S MolecularWeight: 318.35426

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC1=CC=C(C=C1)[N+](=O)[O-])C2=CN=NC(=N2)SC

Isomeric SMILES

CC/C(=N/NC1=CC=C(C=C1)[N+](=O)[O-])/C2=CN=NC(=N2)SC

InChI

InChI=1S/C13H14N6O2S/c1-3-11(12-8-14-18-13(15-12)22-2)17-16-9-4-6-10(7-5-9)19(20)21/h4-8,16H,3H2,1-2H3/b17-11-