tert-butyl 4-[7-[(4-cyano-2-methyl-pyrazol-3-yl)carbamoyl]-4-methoxy-1,3-benzothiazol-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[7-[(4-cyano-2-methyl-pyrazol-3-yl)carbamoyl]-4-methoxy-1,3-benzothiazol-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[7-[(4-cyano-2-methyl-pyrazol-3-yl)carbamoyl]-4-methoxy-1,3-benzothiazol-2-yl]piperazine-1-carboxylate CAS Name: 4-[7-[[(4-cyano-2-methyl-3-pyrazolyl)amino]-oxomethyl]-4-methoxy-1,3-benzothiazol-2-yl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[7-[(4-cyano-2-methylpyrazol-3-yl)carbamoyl]-4-methoxy-1,3-benzothiazol-2-yl]piperazine-1-carboxylate Traditional Name: 4-[7-[(4-cyano-2-methyl-pyrazol-3-yl)carbamoyl]-4-methoxy-1,3-benzothiazol-2-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H27N7O4S MolecularWeight: 497.56998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=C(C=CC(=C3S2)C(=O)NC4=C(C=NN4C)C#N)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=C(C=CC(=C3S2)C(=O)NC4=C(C=NN4C)C#N)OC

InChI

InChI=1S/C23H27N7O4S/c1-23(2,3)34-22(32)30-10-8-29(9-11-30)21-26-17-16(33-5)7-6-15(18(17)35-21)20(31)27-19-14(12-24)13-25-28(19)4/h6-7,13H,8-11H2,1-5H3,(H,27,31)