2-[(3-methoxyphenyl)amino]-8-phenyl-6-thiophen-2-yl-pteridin-7-one

Systemtic Name: 2-[(3-methoxyphenyl)amino]-8-phenyl-6-thiophen-2-yl-pteridin-7-one Openeye Name: 2-(3-methoxyanilino)-8-phenyl-6-(2-thienyl)pteridin-7-one CAS Name: 2-(3-methoxyanilino)-8-phenyl-6-thiophen-2-yl-7-pteridinone IUPAC Name: 2-(3-methoxyanilino)-8-phenyl-6-thiophen-2-ylpteridin-7-one Traditional Name: 2-(m-anisidino)-8-phenyl-6-(2-thienyl)pteridin-7-one Formula: C23H17N5O2S MolecularWeight: 427.47838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C23H17N5O2S/c1-30-17-10-5-7-15(13-17)25-23-24-14-18-21(27-23)28(16-8-3-2-4-9-16)22(29)20(26-18)19-11-6-12-31-19/h2-14H,1H3,(H,24,25,27)