ethyl 4-[(2-benzamido-4,5,6,7-tetrahydro-1,3-benzothiazol-4-yl)carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(2-benzamido-4,5,6,7-tetrahydro-1,3-benzothiazol-4-yl)carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-(2-benzamido-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(2-benzamido-4,5,6,7-tetrahydro-1,3-benzothiazol-4-yl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-benzamido-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(2-benzamido-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CCCC3=C2N=C(S3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CCCC3=C2N=C(S3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H26N4O4S/c1-2-30-22(29)26-13-11-25(12-14-26)20(28)16-9-6-10-17-18(16)23-21(31-17)24-19(27)15-7-4-3-5-8-15/h3-5,7-8,16H,2,6,9-14H2,1H3,(H,23,24,27)