tert-butyl N-[4-[[2-(3-azanylpropylamino)-4-methyl-pentanoyl]amino]-3-oxidanyl-1,5-diphenyl-pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-[[2-(3-azanylpropylamino)-4-methyl-pentanoyl]amino]-3-oxidanyl-1,5-diphenyl-pentan-2-yl]carbamate Openeye Name: tert-butyl N-[3-[[2-(3-aminopropylamino)-4-methyl-pentanoyl]amino]-1-benzyl-2-hydroxy-4-phenyl-butyl]carbamate CAS Name: N-[4-[[2-(3-aminopropylamino)-4-methyl-1-oxopentyl]amino]-3-hydroxy-1,5-diphenylpentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[2-(3-aminopropylamino)-4-methylpentanoyl]amino]-3-hydroxy-1,5-diphenylpentan-2-yl]carbamate Traditional Name: N-[3-[[2-(3-aminopropylamino)-4-methyl-pentanoyl]amino]-1-benzyl-2-hydroxy-4-phenyl-butyl]carbamic acid tert-butyl ester Formula: C31H48N4O4 MolecularWeight: 540.73722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O)NCCCN

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O)NCCCN

InChI

InChI=1S/C31H48N4O4/c1-22(2)19-27(33-18-12-17-32)29(37)34-25(20-23-13-8-6-9-14-23)28(36)26(21-24-15-10-7-11-16-24)35-30(38)39-31(3,4)5/h6-11,13-16,22,25-28,33,36H,12,17-21,32H2,1-5H3,(H,34,37)(H,35,38)