2-(1,3-benzothiazol-2-ylsulfanyl)-9-methyl-3-[(3-morpholin-4-ylsulfonylphenyl)iminomethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-9-methyl-3-[(3-morpholin-4-ylsulfonylphenyl)iminomethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-9-methyl-3-[(3-morpholinosulfonylphenyl)iminomethyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-(1,3-benzothiazol-2-ylthio)-9-methyl-3-[[3-(4-morpholinylsulfonyl)phenyl]iminomethyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-9-methyl-3-[(3-morpholin-4-ylsulfonylphenyl)iminomethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-9-methyl-3-[(3-morpholinosulfonylphenyl)iminomethyl]pyrido[1,2-a]pyrimidin-4-one Formula: C27H23N5O4S3 MolecularWeight: 577.69762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C(C2=O)C=NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)SC5=NC6=CC=CC=C6S5

Isomeric SMILES

CC1=CC=CN2C1=NC(=C(C2=O)C=NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)SC5=NC6=CC=CC=C6S5

InChI

InChI=1S/C27H23N5O4S3/c1-18-6-5-11-32-24(18)30-25(38-27-29-22-9-2-3-10-23(22)37-27)21(26(32)33)17-28-19-7-4-8-20(16-19)39(34,35)31-12-14-36-15-13-31/h2-11,16-17H,12-15H2,1H3