(Z)-but-2-enedioate; 4-(2-piperazin-1-ylpyrido[3,2-d]pyrimidin-4-yl)thiomorpholine

Systemtic Name: (Z)-but-2-enedioate; 4-(2-piperazin-1-ylpyrido[3,2-d]pyrimidin-4-yl)thiomorpholine Openeye Name: (Z)-but-2-enedioate; 4-(2-piperazin-1-ylpyrido[3,2-d]pyrimidin-4-yl)thiomorpholine CAS Name: (Z)-2-butenedioate; 4-[2-(1-piperazinyl)-4-pyrido[3,2-d]pyrimidinyl]thiomorpholine IUPAC Name: (Z)-but-2-enedioate; 4-(2-piperazin-1-ylpyrido[3,2-d]pyrimidin-4-yl)thiomorpholine Traditional Name: 4-(2-piperazinopyrido[3,2-d]pyrimidin-4-yl)thiomorpholine maleate Formula: C19H22N6O4S-2 MolecularWeight: 430.48078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=C(C(=N2)N4CCSCC4)N=CC=C3.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=NC3=C(C(=N2)N4CCSCC4)N=CC=C3.C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C15H20N6S.C4H4O4/c1-2-12-13(17-3-1)14(20-8-10-22-11-9-20)19-15(18-12)21-6-4-16-5-7-21;5-3(6)1-2-4(7)8/h1-3,16H,4-11H2;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1-