methyl 4-[[2-[(2-azanylpyridin-4-yl)methylamino]-2-oxidanylidene-ethyl]carbamoyl]-4-(methoxycarbonylamino)-6-phenyl-hexanoate

Systemtic Name: methyl 4-[[2-[(2-azanylpyridin-4-yl)methylamino]-2-oxidanylidene-ethyl]carbamoyl]-4-(methoxycarbonylamino)-6-phenyl-hexanoate Openeye Name: methyl 4-[[2-[(2-amino-4-pyridyl)methylamino]-2-oxo-ethyl]carbamoyl]-4-(methoxycarbonylamino)-6-phenyl-hexanoate CAS Name: 4-[[[2-[(2-amino-4-pyridinyl)methylamino]-2-oxoethyl]amino]-oxomethyl]-4-(methoxycarbonylamino)-6-phenylhexanoic acid methyl ester IUPAC Name: methyl 4-[[2-[(2-aminopyridin-4-yl)methylamino]-2-oxoethyl]carbamoyl]-4-(methoxycarbonylamino)-6-phenylhexanoate Traditional Name: 4-[[2-[(2-amino-4-pyridyl)methylamino]-2-keto-ethyl]carbamoyl]-4-(carbomethoxyamino)-6-phenyl-hexanoic acid methyl ester Formula: C24H31N5O6 MolecularWeight: 485.53284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CCC1=CC=CC=C1)(C(=O)NCC(=O)NCC2=CC(=NC=C2)N)NC(=O)OC

Isomeric SMILES

COC(=O)CCC(CCC1=CC=CC=C1)(C(=O)NCC(=O)NCC2=CC(=NC=C2)N)NC(=O)OC

InChI

InChI=1S/C24H31N5O6/c1-34-21(31)9-12-24(29-23(33)35-2,11-8-17-6-4-3-5-7-17)22(32)28-16-20(30)27-15-18-10-13-26-19(25)14-18/h3-7,10,13-14H,8-9,11-12,15-16H2,1-2H3,(H2,25,26)(H,27,30)(H,28,32)(H,29,33)