N-(6-ethoxy-5-nitro-pyrimidin-4-yl)-6-methyl-1,3-benzothiazol-2-amine

Systemtic Name: N-(6-ethoxy-5-nitro-pyrimidin-4-yl)-6-methyl-1,3-benzothiazol-2-amine Openeye Name: N-(6-ethoxy-5-nitro-pyrimidin-4-yl)-6-methyl-1,3-benzothiazol-2-amine CAS Name: N-(6-ethoxy-5-nitro-4-pyrimidinyl)-6-methyl-1,3-benzothiazol-2-amine IUPAC Name: N-(6-ethoxy-5-nitropyrimidin-4-yl)-6-methyl-1,3-benzothiazol-2-amine Traditional Name: (6-ethoxy-5-nitro-pyrimidin-4-yl)-(6-methyl-1,3-benzothiazol-2-yl)amine Formula: C14H13N5O3S MolecularWeight: 331.34972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=NC(=C1[N+](=O)[O-])NC2=NC3=C(S2)C=C(C=C3)C

Isomeric SMILES

CCOC1=NC=NC(=C1[N+](=O)[O-])NC2=NC3=C(S2)C=C(C=C3)C

InChI

InChI=1S/C14H13N5O3S/c1-3-22-13-11(19(20)21)12(15-7-16-13)18-14-17-9-5-4-8(2)6-10(9)23-14/h4-7H,3H2,1-2H3,(H,15,16,17,18)