ethyl 4-[2-(1,3-benzothiazol-2-yl)pyridin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(1,3-benzothiazol-2-yl)pyridin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(1,3-benzothiazol-2-yl)pyridine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-(1,3-benzothiazol-2-yl)-3-pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(1,3-benzothiazol-2-yl)pyridine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-(1,3-benzothiazol-2-yl)nicotinoyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20N4O3S/c1-2-27-20(26)24-12-10-23(11-13-24)19(25)14-6-5-9-21-17(14)18-22-15-7-3-4-8-16(15)28-18/h3-9H,2,10-13H2,1H3