3-(2,4-dinitrophenyl)sulfanyl-N5,N6-diethyl-1,2,4-triazine-5,6-diamine

Systemtic Name: 3-(2,4-dinitrophenyl)sulfanyl-N5,N6-diethyl-1,2,4-triazine-5,6-diamine Openeye Name: 3-(2,4-dinitrophenyl)sulfanyl-N5,N6-diethyl-1,2,4-triazine-5,6-diamine CAS Name: 3-[(2,4-dinitrophenyl)thio]-N5,N6-diethyl-1,2,4-triazine-5,6-diamine IUPAC Name: 3-(2,4-dinitrophenyl)sulfanyl-5-N,6-N-diethyl-1,2,4-triazine-5,6-diamine Traditional Name: [3-[(2,4-dinitrophenyl)thio]-5-(ethylamino)-1,2,4-triazin-6-yl]-ethyl-amine Formula: C13H15N7O4S MolecularWeight: 365.3677

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(N=NC(=N1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])NCC

Isomeric SMILES

CCNC1=C(N=NC(=N1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])NCC

InChI

InChI=1S/C13H15N7O4S/c1-3-14-11-12(15-4-2)17-18-13(16-11)25-10-6-5-8(19(21)22)7-9(10)20(23)24/h5-7H,3-4H2,1-2H3,(H,15,17)(H,14,16,18)