2-(furan-3-yl)-1-methyl-5-nitro-6-[(phenylmethyl)amino]pyrimidine-4-thione

Systemtic Name: 2-(furan-3-yl)-1-methyl-5-nitro-6-[(phenylmethyl)amino]pyrimidine-4-thione Openeye Name: 6-(benzylamino)-2-(3-furyl)-1-methyl-5-nitro-pyrimidine-4-thione CAS Name: 2-(3-furanyl)-1-methyl-5-nitro-6-[(phenylmethyl)amino]-4-pyrimidinethione IUPAC Name: 6-(benzylamino)-2-(furan-3-yl)-1-methyl-5-nitropyrimidine-4-thione Traditional Name: 6-(benzylamino)-2-(3-furyl)-1-methyl-5-nitro-pyrimidine-4-thione Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O3S/c1-19-14(12-7-8-23-10-12)18-16(24)13(20(21)22)15(19)17-9-11-5-3-2-4-6-11/h2-8,10,17H,9H2,1H3