1-(2,2-dimethylpropanoyl)-N-[3-naphthalen-2-yl-1-oxidanylidene-1-[[2-oxidanyl-3-(1,3-thiazol-2-ylmethylamino)propyl]amino]propan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(2,2-dimethylpropanoyl)-N-[3-naphthalen-2-yl-1-oxidanylidene-1-[[2-oxidanyl-3-(1,3-thiazol-2-ylmethylamino)propyl]amino]propan-2-yl]pyrrolidine-2-carboxamide Openeye Name: 1-(2,2-dimethylpropanoyl)-N-[2-[[2-hydroxy-3-(thiazol-2-ylmethylamino)propyl]amino]-1-(2-naphthylmethyl)-2-oxo-ethyl]pyrrolidine-2-carboxamide CAS Name: 1-(2,2-dimethyl-1-oxopropyl)-N-[1-[[2-hydroxy-3-(2-thiazolylmethylamino)propyl]amino]-3-(2-naphthalenyl)-1-oxopropan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(2,2-dimethylpropanoyl)-N-[1-[[2-hydroxy-3-(1,3-thiazol-2-ylmethylamino)propyl]amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]pyrrolidine-2-carboxamide Traditional Name: N-[2-[[2-hydroxy-3-(thiazol-2-ylmethylamino)propyl]amino]-2-keto-1-(2-naphthylmethyl)ethyl]-1-pivaloyl-pyrrolidine-2-carboxamide Formula: C30H39N5O4S MolecularWeight: 565.72676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCCC1C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCC(CNCC4=NC=CS4)O

Isomeric SMILES

CC(C)(C)C(=O)N1CCCC1C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCC(CNCC4=NC=CS4)O

InChI

InChI=1S/C30H39N5O4S/c1-30(2,3)29(39)35-13-6-9-25(35)28(38)34-24(16-20-10-11-21-7-4-5-8-22(21)15-20)27(37)33-18-23(36)17-31-19-26-32-12-14-40-26/h4-5,7-8,10-12,14-15,23-25,31,36H,6,9,13,16-19H2,1-3H3,(H,33,37)(H,34,38)