methyl 2-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[4-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[4-(1,3-benzothiazol-2-yl)piperidino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H22N4O3S/c1-30-23(29)15-6-7-16-18(12-15)24-20(26-21(16)28)13-27-10-8-14(9-11-27)22-25-17-4-2-3-5-19(17)31-22/h2-7,12,14H,8-11,13H2,1H3,(H,24,26,28)