2-azanyl-3-(cyclohexylmethylsulfanyl)-N-[(4-phenoxyphenyl)methyl]propanamide

Systemtic Name: 2-azanyl-3-(cyclohexylmethylsulfanyl)-N-[(4-phenoxyphenyl)methyl]propanamide Openeye Name: 2-amino-3-(cyclohexylmethylsulfanyl)-N-[(4-phenoxyphenyl)methyl]propanamide CAS Name: 2-amino-3-(cyclohexylmethylthio)-N-[(4-phenoxyphenyl)methyl]propanamide IUPAC Name: 2-amino-3-(cyclohexylmethylsulfanyl)-N-[(4-phenoxyphenyl)methyl]propanamide Traditional Name: 2-amino-3-(cyclohexylmethylthio)-N-(4-phenoxybenzyl)propionamide Formula: C23H30N2O2S MolecularWeight: 398.5615

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CSCC(C(=O)NCC2=CC=C(C=C2)OC3=CC=CC=C3)N

Isomeric SMILES

C1CCC(CC1)CSCC(C(=O)NCC2=CC=C(C=C2)OC3=CC=CC=C3)N

InChI

InChI=1S/C23H30N2O2S/c24-22(17-28-16-19-7-3-1-4-8-19)23(26)25-15-18-11-13-21(14-12-18)27-20-9-5-2-6-10-20/h2,5-6,9-14,19,22H,1,3-4,7-8,15-17,24H2,(H,25,26)