N-[1-[2-(2-azanylethanoylamino)ethylamino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-1-(2-ethylbutanoyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[1-[2-(2-azanylethanoylamino)ethylamino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-1-(2-ethylbutanoyl)pyrrolidine-2-carboxamide Openeye Name: N-[2-[2-[(2-aminoacetyl)amino]ethylamino]-1-(2-naphthylmethyl)-2-oxo-ethyl]-1-(2-ethylbutanoyl)pyrrolidine-2-carboxamide CAS Name: N-[1-[2-[(2-amino-1-oxoethyl)amino]ethylamino]-3-(2-naphthalenyl)-1-oxopropan-2-yl]-1-(2-ethyl-1-oxobutyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[1-[2-[(2-aminoacetyl)amino]ethylamino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-1-(2-ethylbutanoyl)pyrrolidine-2-carboxamide Traditional Name: 1-(2-ethylbutanoyl)-N-[2-[2-(glycylamino)ethylamino]-2-keto-1-(2-naphthylmethyl)ethyl]pyrrolidine-2-carboxamide Formula: C28H39N5O4 MolecularWeight: 509.64036

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCCC1C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCCNC(=O)CN

Isomeric SMILES

CCC(CC)C(=O)N1CCCC1C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCCNC(=O)CN

InChI

InChI=1S/C28H39N5O4/c1-3-20(4-2)28(37)33-15-7-10-24(33)27(36)32-23(26(35)31-14-13-30-25(34)18-29)17-19-11-12-21-8-5-6-9-22(21)16-19/h5-6,8-9,11-12,16,20,23-24H,3-4,7,10,13-15,17-18,29H2,1-2H3,(H,30,34)(H,31,35)(H,32,36)