N-[1-azanyl-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-5-methyl-2-(phenylmethyl)-4-sulfanyl-heptanamide

Systemtic Name: N-[1-azanyl-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-5-methyl-2-(phenylmethyl)-4-sulfanyl-heptanamide Openeye Name: N-[2-amino-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]-2-benzyl-5-methyl-4-sulfanyl-heptanamide CAS Name: N-[1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-4-mercapto-5-methyl-2-(phenylmethyl)heptanamide IUPAC Name: N-[1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-2-benzyl-5-methyl-4-sulfanylheptanamide Traditional Name: N-[2-amino-1-(4-hydroxybenzyl)-2-keto-ethyl]-2-benzyl-4-mercapto-5-methyl-enanthamide Formula: C24H32N2O3S MolecularWeight: 428.58748

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CC(CC1=CC=CC=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)N)S

Isomeric SMILES

CCC(C)C(CC(CC1=CC=CC=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)N)S

InChI

InChI=1S/C24H32N2O3S/c1-3-16(2)22(30)15-19(13-17-7-5-4-6-8-17)24(29)26-21(23(25)28)14-18-9-11-20(27)12-10-18/h4-12,16,19,21-22,27,30H,3,13-15H2,1-2H3,(H2,25,28)(H,26,29)