ethyl 4-[[4-azanyl-3-[(phenylmethyl)carbamoyl]-1,2-thiazol-5-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[4-azanyl-3-[(phenylmethyl)carbamoyl]-1,2-thiazol-5-yl]carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[4-amino-3-(benzylcarbamoyl)isothiazole-5-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[4-amino-3-[oxo-[(phenylmethyl)amino]methyl]-5-isothiazolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-amino-3-(benzylcarbamoyl)-1,2-thiazole-5-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[4-amino-3-(benzylcarbamoyl)isothiazole-5-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C(=NS2)C(=O)NCC3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C(=NS2)C(=O)NCC3=CC=CC=C3)N

InChI

InChI=1S/C19H23N5O4S/c1-2-28-19(27)24-10-8-23(9-11-24)18(26)16-14(20)15(22-29-16)17(25)21-12-13-6-4-3-5-7-13/h3-7H,2,8-12,20H2,1H3,(H,21,25)