(2S)-2-acetamido-N-(1-adamantyl)-3-(4-propan-2-ylphenyl)sulfanyl-propanamide

Systemtic Name: (2S)-2-acetamido-N-(1-adamantyl)-3-(4-propan-2-ylphenyl)sulfanyl-propanamide Openeye Name: (2S)-2-acetamido-N-(1-adamantyl)-3-(4-isopropylphenyl)sulfanyl-propanamide CAS Name: (2S)-2-acetamido-N-(1-adamantyl)-3-[(4-propan-2-ylphenyl)thio]propanamide IUPAC Name: (2S)-2-acetamido-N-(1-adamantyl)-3-(4-propan-2-ylphenyl)sulfanylpropanamide Traditional Name: (2S)-2-acetamido-N-(1-adamantyl)-3-(p-cumenylthio)propionamide Formula: C24H34N2O2S MolecularWeight: 414.60396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SCC(C(=O)NC23CC4CC(C2)CC(C4)C3)NC(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SC[C@H](C(=O)NC23CC4CC(C2)CC(C4)C3)NC(=O)C

InChI

InChI=1S/C24H34N2O2S/c1-15(2)20-4-6-21(7-5-20)29-14-22(25-16(3)27)23(28)26-24-11-17-8-18(12-24)10-19(9-17)13-24/h4-7,15,17-19,22H,8-14H2,1-3H3,(H,25,27)(H,26,28)/t17?,18?,19?,22-,24?/m1/s1