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

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-5-(4-ethylphenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(2-chloro-4-nitro-phenyl)-5-(4-ethylphenyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(2-chloro-4-nitrophenyl)-5-(4-ethylphenyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(2-chloro-4-nitrophenyl)-5-(4-ethylphenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: (2-chloro-4-nitro-phenyl)-[5-(4-ethylphenyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C20H15ClN4O2S MolecularWeight: 410.8767

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H15ClN4O2S/c1-2-12-3-5-13(6-4-12)15-10-28-20-18(15)19(22-11-23-20)24-17-8-7-14(25(26)27)9-16(17)21/h3-11H,2H2,1H3,(H,22,23,24)