3-[(7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)carbonyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 3-[(7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)carbonyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 3-[7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 3-[[7-methyl-2-(3-thiophenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-oxomethyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 3-(7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl)pyrido[1,2-a]pyrimidin-4-one Traditional Name: 3-[7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl]pyrido[1,2-a]pyrimidin-4-one Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(CN(C2)C(=O)C3=CN=C4C=CC=CN4C3=O)C5=CSC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)OC(CN(C2)C(=O)C3=CN=C4C=CC=CN4C3=O)C5=CSC=C5

InChI

InChI=1S/C23H19N3O3S/c1-15-5-6-19-17(10-15)12-25(13-20(29-19)16-7-9-30-14-16)22(27)18-11-24-21-4-2-3-8-26(21)23(18)28/h2-11,14,20H,12-13H2,1H3