5-[2-[[4-(dimethylamino)-3-nitro-phenyl]amino]pyrimidin-4-yl]-3-ethyl-4-methyl-1,3-thiazol-2-one

Systemtic Name: 5-[2-[[4-(dimethylamino)-3-nitro-phenyl]amino]pyrimidin-4-yl]-3-ethyl-4-methyl-1,3-thiazol-2-one Openeye Name: 5-[2-[4-(dimethylamino)-3-nitro-anilino]pyrimidin-4-yl]-3-ethyl-4-methyl-thiazol-2-one CAS Name: 5-[2-[4-(dimethylamino)-3-nitroanilino]-4-pyrimidinyl]-3-ethyl-4-methyl-2-thiazolone IUPAC Name: 5-[2-[4-(dimethylamino)-3-nitroanilino]pyrimidin-4-yl]-3-ethyl-4-methyl-1,3-thiazol-2-one Traditional Name: 5-[2-[4-(dimethylamino)-3-nitro-anilino]pyrimidin-4-yl]-3-ethyl-4-methyl-4-thiazolin-2-one Formula: C18H20N6O3S MolecularWeight: 400.4548

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(SC1=O)C2=NC(=NC=C2)NC3=CC(=C(C=C3)N(C)C)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=C(SC1=O)C2=NC(=NC=C2)NC3=CC(=C(C=C3)N(C)C)[N+](=O)[O-])C

InChI

InChI=1S/C18H20N6O3S/c1-5-23-11(2)16(28-18(23)25)13-8-9-19-17(21-13)20-12-6-7-14(22(3)4)15(10-12)24(26)27/h6-10H,5H2,1-4H3,(H,19,20,21)