ethyl 6-azanyl-7-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-methyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 6-azanyl-7-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-methyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 6-amino-7-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-methyl-4-oxo-quinoline-3-carboxylate CAS Name: 6-amino-7-[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-1-methyl-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-7-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-methyl-4-oxoquinoline-3-carboxylate Traditional Name: 6-amino-7-[4-(1,3-benzothiazol-2-yl)piperazino]-4-keto-1-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C24H25N5O3S MolecularWeight: 463.552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)N)N3CCN(CC3)C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)N)N3CCN(CC3)C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C24H25N5O3S/c1-3-32-23(31)16-14-27(2)19-13-20(17(25)12-15(19)22(16)30)28-8-10-29(11-9-28)24-26-18-6-4-5-7-21(18)33-24/h4-7,12-14H,3,8-11,25H2,1-2H3