(E)-3-[2-[3-[1-(dimethylamino)ethylcarbamoyl]piperidin-1-yl]-4-oxidanylidene-8-[2-(4-propan-2-yl-1,3-thiazol-2-yl)ethyl]pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-[3-[1-(dimethylamino)ethylcarbamoyl]piperidin-1-yl]-4-oxidanylidene-8-[2-(4-propan-2-yl-1,3-thiazol-2-yl)ethyl]pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoic acid Openeye Name: (E)-3-[2-[3-[1-(dimethylamino)ethylcarbamoyl]-1-piperidyl]-8-[2-(4-isopropylthiazol-2-yl)ethyl]-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoic acid CAS Name: (E)-3-[2-[3-[[1-(dimethylamino)ethylamino]-oxomethyl]-1-piperidinyl]-4-oxo-8-[2-(4-propan-2-yl-2-thiazolyl)ethyl]-3-pyrido[1,2-a]pyrimidinyl]-2-propenoic acid IUPAC Name: (E)-3-[2-[3-[1-(dimethylamino)ethylcarbamoyl]piperidin-1-yl]-4-oxo-8-[2-(4-propan-2-yl-1,3-thiazol-2-yl)ethyl]pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoic acid Traditional Name: (E)-3-[2-[3-[1-(dimethylamino)ethylcarbamoyl]piperidino]-8-[2-(4-isopropylthiazol-2-yl)ethyl]-4-keto-pyrido[1,2-a]pyrimidin-3-yl]acrylic acid Formula: C29H38N6O4S MolecularWeight: 566.71482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CSC(=N1)CCC2=CC3=NC(=C(C(=O)N3C=C2)C=CC(=O)O)N4CCCC(C4)C(=O)NC(C)N(C)C

Isomeric SMILES

CC(C)C1=CSC(=N1)CCC2=CC3=NC(=C(C(=O)N3C=C2)/C=C/C(=O)O)N4CCCC(C4)C(=O)NC(C)N(C)C

InChI

InChI=1S/C29H38N6O4S/c1-18(2)23-17-40-25(31-23)10-8-20-12-14-35-24(15-20)32-27(22(29(35)39)9-11-26(36)37)34-13-6-7-21(16-34)28(38)30-19(3)33(4)5/h9,11-12,14-15,17-19,21H,6-8,10,13,16H2,1-5H3,(H,30,38)(H,36,37)/b11-9+