tert-butyl N-[(2R)-1-(2,2-diphenylethylamino)-3-(1H-indol-3-yl)-1-sulfanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-(2,2-diphenylethylamino)-3-(1H-indol-3-yl)-1-sulfanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-2-(2,2-diphenylethylamino)-1-(1H-indol-3-ylmethyl)-2-thioxo-ethyl]carbamate CAS Name: N-[(2R)-1-(2,2-diphenylethylamino)-3-(1H-indol-3-yl)-1-sulfanylidenepropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-(2,2-diphenylethylamino)-3-(1H-indol-3-yl)-1-sulfanylidenepropan-2-yl]carbamate Traditional Name: N-[(1R)-2-(2,2-diphenylethylamino)-1-(1H-indol-3-ylmethyl)-2-thioxo-ethyl]carbamic acid tert-butyl ester Formula: C30H33N3O2S MolecularWeight: 499.66692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=S)NCC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CC1=CNC2=CC=CC=C21)C(=S)NCC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H33N3O2S/c1-30(2,3)35-29(34)33-27(18-23-19-31-26-17-11-10-16-24(23)26)28(36)32-20-25(21-12-6-4-7-13-21)22-14-8-5-9-15-22/h4-17,19,25,27,31H,18,20H2,1-3H3,(H,32,36)(H,33,34)/t27-/m1/s1