6-methyl-2-(4-methylpiperazin-1-yl)-8-(thiophen-2-ylmethyl)pteridin-7-one

Systemtic Name: 6-methyl-2-(4-methylpiperazin-1-yl)-8-(thiophen-2-ylmethyl)pteridin-7-one Openeye Name: 6-methyl-2-(4-methylpiperazin-1-yl)-8-(2-thienylmethyl)pteridin-7-one CAS Name: 6-methyl-2-(4-methyl-1-piperazinyl)-8-(thiophen-2-ylmethyl)-7-pteridinone IUPAC Name: 6-methyl-2-(4-methylpiperazin-1-yl)-8-(thiophen-2-ylmethyl)pteridin-7-one Traditional Name: 6-methyl-2-(4-methylpiperazino)-8-(2-thenyl)pteridin-7-one Formula: C17H20N6OS MolecularWeight: 356.4453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CN=C(N=C2N(C1=O)CC3=CC=CS3)N4CCN(CC4)C

Isomeric SMILES

CC1=NC2=CN=C(N=C2N(C1=O)CC3=CC=CS3)N4CCN(CC4)C

InChI

InChI=1S/C17H20N6OS/c1-12-16(24)23(11-13-4-3-9-25-13)15-14(19-12)10-18-17(20-15)22-7-5-21(2)6-8-22/h3-4,9-10H,5-8,11H2,1-2H3