2-[(3-methoxyphenyl)amino]-6-phenethyl-8-(thiophen-2-ylmethyl)pteridin-7-one

Systemtic Name: 2-[(3-methoxyphenyl)amino]-6-phenethyl-8-(thiophen-2-ylmethyl)pteridin-7-one Openeye Name: 2-(3-methoxyanilino)-6-phenethyl-8-(2-thienylmethyl)pteridin-7-one CAS Name: 2-(3-methoxyanilino)-6-phenethyl-8-(thiophen-2-ylmethyl)-7-pteridinone IUPAC Name: 2-(3-methoxyanilino)-6-phenethyl-8-(thiophen-2-ylmethyl)pteridin-7-one Traditional Name: 2-(m-anisidino)-6-phenethyl-8-(2-thenyl)pteridin-7-one Formula: C26H23N5O2S MolecularWeight: 469.55812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC=C3C(=N2)N(C(=O)C(=N3)CCC4=CC=CC=C4)CC5=CC=CS5

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC=C3C(=N2)N(C(=O)C(=N3)CCC4=CC=CC=C4)CC5=CC=CS5

InChI

InChI=1S/C26H23N5O2S/c1-33-20-10-5-9-19(15-20)28-26-27-16-23-24(30-26)31(17-21-11-6-14-34-21)25(32)22(29-23)13-12-18-7-3-2-4-8-18/h2-11,14-16H,12-13,17H2,1H3,(H,27,28,30)