tert-butyl N-[1-[2-[(5-cyanothiophen-2-yl)methylcarbamoyl]pyrrolidin-1-yl]-1-oxidanylidene-3,3-diphenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[2-[(5-cyanothiophen-2-yl)methylcarbamoyl]pyrrolidin-1-yl]-1-oxidanylidene-3,3-diphenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzhydryl-2-[2-[(5-cyano-2-thienyl)methylcarbamoyl]pyrrolidin-1-yl]-2-oxo-ethyl]carbamate CAS Name: N-[1-[2-[[(5-cyano-2-thiophenyl)methylamino]-oxomethyl]-1-pyrrolidinyl]-1-oxo-3,3-diphenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[2-[(5-cyanothiophen-2-yl)methylcarbamoyl]pyrrolidin-1-yl]-1-oxo-3,3-diphenylpropan-2-yl]carbamate Traditional Name: N-[1-benzhydryl-2-[2-[(5-cyano-2-thienyl)methylcarbamoyl]pyrrolidino]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C31H34N4O4S MolecularWeight: 558.69106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)N3CCCC3C(=O)NCC4=CC=C(S4)C#N

Isomeric SMILES

CC(C)(C)OC(=O)NC(C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)N3CCCC3C(=O)NCC4=CC=C(S4)C#N

InChI

InChI=1S/C31H34N4O4S/c1-31(2,3)39-30(38)34-27(26(21-11-6-4-7-12-21)22-13-8-5-9-14-22)29(37)35-18-10-15-25(35)28(36)33-20-24-17-16-23(19-32)40-24/h4-9,11-14,16-17,25-27H,10,15,18,20H2,1-3H3,(H,33,36)(H,34,38)