2-(3,5-dimethylpiperidin-1-yl)-N-[4-(1-ethoxyethenyl)phenyl]-4,7-bis(oxidanylidene)-1,5,6,8-tetrahydropyrido[2,3-d]pyrimidine-5-carboxamide hydrate

Systemtic Name: 2-(3,5-dimethylpiperidin-1-yl)-N-[4-(1-ethoxyethenyl)phenyl]-4,7-bis(oxidanylidene)-1,5,6,8-tetrahydropyrido[2,3-d]pyrimidine-5-carboxamide hydrate Openeye Name: 2-(3,5-dimethyl-1-piperidyl)-N-[4-(1-ethoxyvinyl)phenyl]-4,7-dioxo-1,5,6,8-tetrahydropyrido[2,3-d]pyrimidine-5-carboxamide hydrate CAS Name: 2-(3,5-dimethyl-1-piperidinyl)-N-[4-(1-ethoxyethenyl)phenyl]-4,7-dioxo-1,5,6,8-tetrahydropyrido[2,3-d]pyrimidine-5-carboxamide hydrate IUPAC Name: 2-(3,5-dimethylpiperidin-1-yl)-N-[4-(1-ethoxyethenyl)phenyl]-4,7-dioxo-1,5,6,8-tetrahydropyrido[2,3-d]pyrimidine-5-carboxamide hydrate Traditional Name: 2-(3,5-dimethylpiperidino)-N-[4-(1-ethoxyvinyl)phenyl]-4,7-diketo-1,5,6,8-tetrahydropyrido[2,3-d]pyrimidine-5-carboxamide hydrate Formula: C25H33N5O5 MolecularWeight: 483.56002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C)C1=CC=C(C=C1)NC(=O)C2CC(=O)NC3=C2C(=O)N=C(N3)N4CC(CC(C4)C)C.O

Isomeric SMILES

CCOC(=C)C1=CC=C(C=C1)NC(=O)C2CC(=O)NC3=C2C(=O)N=C(N3)N4CC(CC(C4)C)C.O

InChI

InChI=1S/C25H31N5O4.H2O/c1-5-34-16(4)17-6-8-18(9-7-17)26-23(32)19-11-20(31)27-22-21(19)24(33)29-25(28-22)30-12-14(2)10-15(3)13-30;/h6-9,14-15,19H,4-5,10-13H2,1-3H3,(H,26,32)(H2,27,28,29,31,33);1H2