[2-(4-phenylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: [2-(4-phenylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 2-oxidanylidenechromene-3-carboxylate Openeye Name: [2-(4-phenylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid [2-(4-phenyl-1-piperazinyl)-1,3-benzothiazol-6-yl] ester IUPAC Name: [2-(4-phenylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid [2-(4-phenylpiperazino)-1,3-benzothiazol-6-yl] ester Formula: C27H21N3O4S MolecularWeight: 483.53834

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)OC(=O)C5=CC6=CC=CC=C6OC5=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)OC(=O)C5=CC6=CC=CC=C6OC5=O

InChI

InChI=1S/C27H21N3O4S/c31-25(21-16-18-6-4-5-9-23(18)34-26(21)32)33-20-10-11-22-24(17-20)35-27(28-22)30-14-12-29(13-15-30)19-7-2-1-3-8-19/h1-11,16-17H,12-15H2