3-[2-[3-[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]-2-oxidanylidene-5-propan-2-yl-pyrazin-1-yl]butanoylamino]-5-naphthalen-1-ylcarbonyloxy-4-oxidanylidene-pentanoic acid

Systemtic Name: 3-[2-[3-[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]-2-oxidanylidene-5-propan-2-yl-pyrazin-1-yl]butanoylamino]-5-naphthalen-1-ylcarbonyloxy-4-oxidanylidene-pentanoic acid Openeye Name: 3-[2-[5-isopropyl-3-[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]-2-oxo-pyrazin-1-yl]butanoylamino]-5-(naphthalene-1-carbonyloxy)-4-oxo-pentanoic acid CAS Name: 3-[[2-[3-[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]-2-oxo-5-propan-2-yl-1-pyrazinyl]-1-oxobutyl]amino]-5-[1-naphthalenyl(oxo)methoxy]-4-oxopentanoic acid IUPAC Name: 3-[2-[3-[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]-2-oxo-5-propan-2-ylpyrazin-1-yl]butanoylamino]-5-(naphthalene-1-carbonyloxy)-4-oxopentanoic acid Traditional Name: 3-[2-[5-isopropyl-2-keto-3-[(4-methylfurazan-3-yl)methylamino]pyrazin-1-yl]butanoylamino]-4-keto-5-(1-naphthoyloxy)valeric acid Formula: C31H34N6O8 MolecularWeight: 618.63706

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(CC(=O)O)C(=O)COC(=O)C1=CC=CC2=CC=CC=C21)N3C=C(N=C(C3=O)NCC4=NON=C4C)C(C)C

Isomeric SMILES

CCC(C(=O)NC(CC(=O)O)C(=O)COC(=O)C1=CC=CC2=CC=CC=C21)N3C=C(N=C(C3=O)NCC4=NON=C4C)C(C)C

InChI

InChI=1S/C31H34N6O8/c1-5-25(37-15-24(17(2)3)33-28(30(37)42)32-14-23-18(4)35-45-36-23)29(41)34-22(13-27(39)40)26(38)16-44-31(43)21-12-8-10-19-9-6-7-11-20(19)21/h6-12,15,17,22,25H,5,13-14,16H2,1-4H3,(H,32,33)(H,34,41)(H,39,40)