8-(4-methoxyphenyl)-2-piperazin-1-yl-6-thiophen-2-yl-pteridin-7-one

Systemtic Name: 8-(4-methoxyphenyl)-2-piperazin-1-yl-6-thiophen-2-yl-pteridin-7-one Openeye Name: 8-(4-methoxyphenyl)-2-piperazin-1-yl-6-(2-thienyl)pteridin-7-one CAS Name: 8-(4-methoxyphenyl)-2-(1-piperazinyl)-6-thiophen-2-yl-7-pteridinone IUPAC Name: 8-(4-methoxyphenyl)-2-piperazin-1-yl-6-thiophen-2-ylpteridin-7-one Traditional Name: 8-(4-methoxyphenyl)-2-piperazino-6-(2-thienyl)pteridin-7-one Formula: C21H20N6O2S MolecularWeight: 420.4875

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=NC(=NC=C3N=C(C2=O)C4=CC=CS4)N5CCNCC5

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=NC(=NC=C3N=C(C2=O)C4=CC=CS4)N5CCNCC5

InChI

InChI=1S/C21H20N6O2S/c1-29-15-6-4-14(5-7-15)27-19-16(24-18(20(27)28)17-3-2-12-30-17)13-23-21(25-19)26-10-8-22-9-11-26/h2-7,12-13,22H,8-11H2,1H3