3-(4-methoxy-2-nitro-phenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione

Systemtic Name: 3-(4-methoxy-2-nitro-phenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione Openeye Name: 3-(4-methoxy-2-nitro-phenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione CAS Name: 3-(4-methoxy-2-nitrophenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione IUPAC Name: 3-(4-methoxy-2-nitrophenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione Traditional Name: 3-(4-methoxy-2-nitro-phenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC(=S)N1C2=C(C=C(C=C2)OC)[N+](=O)[O-])(C)C

Isomeric SMILES

CC1=CC(NC(=S)N1C2=C(C=C(C=C2)OC)[N+](=O)[O-])(C)C

InChI

InChI=1S/C14H17N3O3S/c1-9-8-14(2,3)15-13(21)16(9)11-6-5-10(20-4)7-12(11)17(18)19/h5-8H,1-4H3,(H,15,21)