tert-butyl N-[(2S)-3-phenyl-1-[[(1R)-1-phenylethyl]amino]-1-sulfanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-3-phenyl-1-[[(1R)-1-phenylethyl]amino]-1-sulfanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-benzyl-2-[[(1R)-1-phenylethyl]amino]-2-thioxo-ethyl]carbamate CAS Name: N-[(2S)-3-phenyl-1-[[(1R)-1-phenylethyl]amino]-1-sulfanylidenepropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-3-phenyl-1-[[(1R)-1-phenylethyl]amino]-1-sulfanylidenepropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-[[(1R)-1-phenylethyl]amino]-2-thioxo-ethyl]carbamic acid tert-butyl ester Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=S)C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=S)[C@H](CC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H28N2O2S/c1-16(18-13-9-6-10-14-18)23-20(27)19(15-17-11-7-5-8-12-17)24-21(25)26-22(2,3)4/h5-14,16,19H,15H2,1-4H3,(H,23,27)(H,24,25)/t16-,19+/m1/s1