(4R)-4-[4-(dimethylamino)-3-nitro-phenyl]-N,N-diethyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: (4R)-4-[4-(dimethylamino)-3-nitro-phenyl]-N,N-diethyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4R)-4-[4-(dimethylamino)-3-nitro-phenyl]-N,N-diethyl-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4R)-4-[4-(dimethylamino)-3-nitrophenyl]-N,N-diethyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4R)-4-[4-(dimethylamino)-3-nitrophenyl]-N,N-diethyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4R)-4-[4-(dimethylamino)-3-nitro-phenyl]-N,N-diethyl-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C18H25N5O3S MolecularWeight: 391.4878

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(NC(=S)NC1C2=CC(=C(C=C2)N(C)C)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)C(=O)C1=C(NC(=S)N[C@@H]1C2=CC(=C(C=C2)N(C)C)[N+](=O)[O-])C

InChI

InChI=1S/C18H25N5O3S/c1-6-22(7-2)17(24)15-11(3)19-18(27)20-16(15)12-8-9-13(21(4)5)14(10-12)23(25)26/h8-10,16H,6-7H2,1-5H3,(H2,19,20,27)/t16-/m1/s1