(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate

Systemtic Name: (7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate Openeye Name: (7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)acetate CAS Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid (7-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (7-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid (4-keto-7-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)COC(=O)COCC3=NC4=CC=CC=C4S3)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)COC(=O)COCC3=NC4=CC=CC=C4S3)C=C1

InChI

InChI=1S/C20H17N3O4S/c1-13-6-7-17-21-14(8-19(24)23(17)9-13)10-27-20(25)12-26-11-18-22-15-4-2-3-5-16(15)28-18/h2-9H,10-12H2,1H3