(E)-3-[8-[(4-tert-butyl-1,3-thiazol-2-yl)carbamoyl]-4-oxidanylidene-2-piperidin-1-yl-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[8-[(4-tert-butyl-1,3-thiazol-2-yl)carbamoyl]-4-oxidanylidene-2-piperidin-1-yl-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoic acid Openeye Name: (E)-3-[8-[(4-tert-butylthiazol-2-yl)carbamoyl]-4-oxo-2-(1-piperidyl)pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoic acid CAS Name: (E)-3-[8-[[(4-tert-butyl-2-thiazolyl)amino]-oxomethyl]-4-oxo-2-(1-piperidinyl)-3-pyrido[1,2-a]pyrimidinyl]-2-propenoic acid IUPAC Name: (E)-3-[8-[(4-tert-butyl-1,3-thiazol-2-yl)carbamoyl]-4-oxo-2-piperidin-1-ylpyrido[1,2-a]pyrimidin-3-yl]prop-2-enoic acid Traditional Name: (E)-3-[8-[(4-tert-butylthiazol-2-yl)carbamoyl]-4-keto-2-piperidino-pyrido[1,2-a]pyrimidin-3-yl]acrylic acid Formula: C24H27N5O4S MolecularWeight: 481.56728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC3=NC(=C(C(=O)N3C=C2)C=CC(=O)O)N4CCCCC4

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC3=NC(=C(C(=O)N3C=C2)/C=C/C(=O)O)N4CCCCC4

InChI

InChI=1S/C24H27N5O4S/c1-24(2,3)17-14-34-23(25-17)27-21(32)15-9-12-29-18(13-15)26-20(28-10-5-4-6-11-28)16(22(29)33)7-8-19(30)31/h7-9,12-14H,4-6,10-11H2,1-3H3,(H,30,31)(H,25,27,32)/b8-7+