N-(2-chloranyl-4-nitro-phenyl)-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(2-chloro-4-nitro-phenyl)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(2-chloro-4-nitrophenyl)-5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(2-chloro-4-nitrophenyl)-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: (2-chloro-4-nitro-phenyl)-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C19H13ClN4O2S MolecularWeight: 396.85012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H13ClN4O2S/c1-11-2-4-12(5-3-11)14-9-27-19-17(14)18(21-10-22-19)23-16-7-6-13(24(25)26)8-15(16)20/h2-10H,1H3,(H,21,22,23)