tert-butyl N-(2,5-dimethylpyrazol-3-yl)carbonyl-N-[3-(1,3-thiazol-2-ylmethylamino)propyl]carbamate

Systemtic Name: tert-butyl N-(2,5-dimethylpyrazol-3-yl)carbonyl-N-[3-(1,3-thiazol-2-ylmethylamino)propyl]carbamate Openeye Name: tert-butyl N-(2,5-dimethylpyrazole-3-carbonyl)-N-[3-(thiazol-2-ylmethylamino)propyl]carbamate CAS Name: N-[(2,5-dimethyl-3-pyrazolyl)-oxomethyl]-N-[3-(2-thiazolylmethylamino)propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(2,5-dimethylpyrazole-3-carbonyl)-N-[3-(1,3-thiazol-2-ylmethylamino)propyl]carbamate Traditional Name: N-(2,5-dimethylpyrazole-3-carbonyl)-N-[3-(thiazol-2-ylmethylamino)propyl]carbamic acid tert-butyl ester Formula: C18H27N5O3S MolecularWeight: 393.50368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)N(CCCNCC2=NC=CS2)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)N(CCCNCC2=NC=CS2)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C18H27N5O3S/c1-13-11-14(22(5)21-13)16(24)23(17(25)26-18(2,3)4)9-6-7-19-12-15-20-8-10-27-15/h8,10-11,19H,6-7,9,12H2,1-5H3