1-methyl-5-nitro-2-phenyl-6-[(phenylmethyl)amino]pyrimidine-4-thione

Systemtic Name: 1-methyl-5-nitro-2-phenyl-6-[(phenylmethyl)amino]pyrimidine-4-thione Openeye Name: 6-(benzylamino)-1-methyl-5-nitro-2-phenyl-pyrimidine-4-thione CAS Name: 1-methyl-5-nitro-2-phenyl-6-[(phenylmethyl)amino]-4-pyrimidinethione IUPAC Name: 6-(benzylamino)-1-methyl-5-nitro-2-phenylpyrimidine-4-thione Traditional Name: 6-(benzylamino)-1-methyl-5-nitro-2-phenyl-pyrimidine-4-thione Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=S)N=C1C2=CC=CC=C2)[N+](=O)[O-])NCC3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C(=S)N=C1C2=CC=CC=C2)[N+](=O)[O-])NCC3=CC=CC=C3

InChI

InChI=1S/C18H16N4O2S/c1-21-16(14-10-6-3-7-11-14)20-18(25)15(22(23)24)17(21)19-12-13-8-4-2-5-9-13/h2-11,19H,12H2,1H3