2-acetamido-N-phenethyl-3-(4-phenylmethoxyphenyl)sulfanyl-N-(phenylmethyl)propanamide

Systemtic Name: 2-acetamido-N-phenethyl-3-(4-phenylmethoxyphenyl)sulfanyl-N-(phenylmethyl)propanamide Openeye Name: 2-acetamido-N-benzyl-3-(4-benzyloxyphenyl)sulfanyl-N-phenethyl-propanamide CAS Name: 2-acetamido-N-phenethyl-3-[(4-phenylmethoxyphenyl)thio]-N-(phenylmethyl)propanamide IUPAC Name: 2-acetamido-N-benzyl-N-phenethyl-3-(4-phenylmethoxyphenyl)sulfanylpropanamide Traditional Name: 2-acetamido-3-[(4-benzoxyphenyl)thio]-N-benzyl-N-phenethyl-propionamide Formula: C33H34N2O3S MolecularWeight: 538.69966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC(CSC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C33H34N2O3S/c1-26(36)34-32(25-39-31-19-17-30(18-20-31)38-24-29-15-9-4-10-16-29)33(37)35(23-28-13-7-3-8-14-28)22-21-27-11-5-2-6-12-27/h2-20,32H,21-25H2,1H3,(H,34,36)