N4-(6-methoxy-1,3-benzothiazol-2-yl)-N6-(2-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(6-methoxy-1,3-benzothiazol-2-yl)-N6-(2-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(6-methoxy-1,3-benzothiazol-2-yl)-N6-(2-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(6-methoxy-1,3-benzothiazol-2-yl)-N6-(2-methoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(6-methoxy-1,3-benzothiazol-2-yl)-6-N-(2-methoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: (6-methoxy-1,3-benzothiazol-2-yl)-[5-nitro-6-(o-anisidino)pyrimidin-4-yl]amine Formula: C19H16N6O4S MolecularWeight: 424.43314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=CC=C4OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=CC=C4OC

InChI

InChI=1S/C19H16N6O4S/c1-28-11-7-8-13-15(9-11)30-19(23-13)24-18-16(25(26)27)17(20-10-21-18)22-12-5-3-4-6-14(12)29-2/h3-10H,1-2H3,(H2,20,21,22,23,24)