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

Systemtic Name: 5-(4-ethoxyphenyl)-N-(4-methoxy-3-nitro-phenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-ethoxyphenyl)-N-(4-methoxy-3-nitro-phenyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-ethoxyphenyl)-N-(4-methoxy-3-nitrophenyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-ethoxyphenyl)-N-(4-methoxy-3-nitrophenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: (4-methoxy-3-nitro-phenyl)-(5-p-phenetylthieno[2,3-d]pyrimidin-4-yl)amine Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC(=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC(=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O4S/c1-3-29-15-7-4-13(5-8-15)16-11-30-21-19(16)20(22-12-23-21)24-14-6-9-18(28-2)17(10-14)25(26)27/h4-12H,3H2,1-2H3,(H,22,23,24)