1-[(4,6-dimethyl-1,3,5-triazin-2-yl)-methyl-amino]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[(4,6-dimethyl-1,3,5-triazin-2-yl)-methyl-amino]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(4,6-dimethyl-1,3,5-triazin-2-yl)-methyl-amino]-3-(4-nitrophenyl)thiourea CAS Name: 1-[(4,6-dimethyl-1,3,5-triazin-2-yl)-methylamino]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(4,6-dimethyl-1,3,5-triazin-2-yl)-methylamino]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[(4,6-dimethyl-s-triazin-2-yl)-methyl-amino]-3-(4-nitrophenyl)thiourea Formula: C13H15N7O2S MolecularWeight: 333.3689

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)N(C)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=NC(=NC(=N1)N(C)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C13H15N7O2S/c1-8-14-9(2)16-12(15-8)19(3)18-13(23)17-10-4-6-11(7-5-10)20(21)22/h4-7H,1-3H3,(H2,17,18,23)