tert-butyl N-[[1-(1-phenylethyl)pyrrolidin-3-yl]-(1,3-thiazol-2-yl)methyl]carbamate

Systemtic Name: tert-butyl N-[[1-(1-phenylethyl)pyrrolidin-3-yl]-(1,3-thiazol-2-yl)methyl]carbamate Openeye Name: tert-butyl N-[[1-(1-phenylethyl)pyrrolidin-3-yl]-thiazol-2-yl-methyl]carbamate CAS Name: N-[[1-(1-phenylethyl)-3-pyrrolidinyl]-(2-thiazolyl)methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[1-(1-phenylethyl)pyrrolidin-3-yl]-(1,3-thiazol-2-yl)methyl]carbamate Traditional Name: N-[[1-(1-phenylethyl)pyrrolidin-3-yl]-thiazol-2-yl-methyl]carbamic acid tert-butyl ester Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CCC(C2)C(C3=NC=CS3)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C1=CC=CC=C1)N2CCC(C2)C(C3=NC=CS3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H29N3O2S/c1-15(16-8-6-5-7-9-16)24-12-10-17(14-24)18(19-22-11-13-27-19)23-20(25)26-21(2,3)4/h5-9,11,13,15,17-18H,10,12,14H2,1-4H3,(H,23,25)