ethyl (E)-4-[[4-methyl-2-[[3-methyl-2-[2-[(5-methyl-1,2-oxazol-3-yl)carbonylamino]propanoylamino]butanoyl]amino]pentanoyl]amino]-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate

Systemtic Name: ethyl (E)-4-[[4-methyl-2-[[3-methyl-2-[2-[(5-methyl-1,2-oxazol-3-yl)carbonylamino]propanoylamino]butanoyl]amino]pentanoyl]amino]-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate Openeye Name: ethyl (E)-4-[[4-methyl-2-[[3-methyl-2-[2-[(5-methylisoxazole-3-carbonyl)amino]propanoylamino]butanoyl]amino]pentanoyl]amino]-5-(2-oxopyrrolidin-3-yl)pent-2-enoate CAS Name: (E)-4-[[4-methyl-2-[[3-methyl-2-[[2-[[(5-methyl-3-isoxazolyl)-oxomethyl]amino]-1-oxopropyl]amino]-1-oxobutyl]amino]-1-oxopentyl]amino]-5-(2-oxo-3-pyrrolidinyl)-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[[4-methyl-2-[[3-methyl-2-[2-[(5-methyl-1,2-oxazole-3-carbonyl)amino]propanoylamino]butanoyl]amino]pentanoyl]amino]-5-(2-oxopyrrolidin-3-yl)pent-2-enoate Traditional Name: (E)-5-(2-ketopyrrolidin-3-yl)-4-[[4-methyl-2-[[3-methyl-2-[2-[(5-methylisoxazole-3-carbonyl)amino]propanoylamino]butanoyl]amino]pentanoyl]amino]pent-2-enoic acid ethyl ester Formula: C30H46N6O8 MolecularWeight: 618.72164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CC1CCNC1=O)NC(=O)C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(C)NC(=O)C2=NOC(=C2)C

Isomeric SMILES

CCOC(=O)/C=C/C(CC1CCNC1=O)NC(=O)C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(C)NC(=O)C2=NOC(=C2)C

InChI

InChI=1S/C30H46N6O8/c1-8-43-24(37)10-9-21(15-20-11-12-31-27(20)39)33-28(40)22(13-16(2)3)34-30(42)25(17(4)5)35-26(38)19(7)32-29(41)23-14-18(6)44-36-23/h9-10,14,16-17,19-22,25H,8,11-13,15H2,1-7H3,(H,31,39)(H,32,41)(H,33,40)(H,34,42)(H,35,38)/b10-9+