tert-butyl N-[(2R)-1-[1-benzothiophen-2-ylcarbonyl(pyridin-3-ylmethyl)amino]propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-[1-benzothiophen-2-ylcarbonyl(pyridin-3-ylmethyl)amino]propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-2-[benzothiophene-2-carbonyl(3-pyridylmethyl)amino]-1-methyl-ethyl]carbamate CAS Name: N-[(2R)-1-[[1-benzothiophen-2-yl(oxo)methyl]-(3-pyridinylmethyl)amino]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-[1-benzothiophene-2-carbonyl(pyridin-3-ylmethyl)amino]propan-2-yl]carbamate Traditional Name: N-[(1R)-2-[benzothiophene-2-carbonyl(3-pyridylmethyl)amino]-1-methyl-ethyl]carbamic acid tert-butyl ester Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC1=CN=CC=C1)C(=O)C2=CC3=CC=CC=C3S2)NC(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](CN(CC1=CN=CC=C1)C(=O)C2=CC3=CC=CC=C3S2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H27N3O3S/c1-16(25-22(28)29-23(2,3)4)14-26(15-17-8-7-11-24-13-17)21(27)20-12-18-9-5-6-10-19(18)30-20/h5-13,16H,14-15H2,1-4H3,(H,25,28)/t16-/m1/s1