(2S)-2-acetamido-3-(1H-indol-3-yl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: (2S)-2-acetamido-3-(1H-indol-3-yl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]propanamide Openeye Name: (2S)-2-acetamido-3-(1H-indol-3-yl)-N-[4-(p-tolyl)thiazol-2-yl]propanamide CAS Name: (2S)-2-acetamido-3-(1H-indol-3-yl)-N-[4-(4-methylphenyl)-2-thiazolyl]propanamide IUPAC Name: (2S)-2-acetamido-3-(1H-indol-3-yl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]propanamide Traditional Name: (2S)-2-acetamido-3-(1H-indol-3-yl)-N-[4-(p-tolyl)thiazol-2-yl]propionamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)C

InChI

InChI=1S/C23H22N4O2S/c1-14-7-9-16(10-8-14)21-13-30-23(26-21)27-22(29)20(25-15(2)28)11-17-12-24-19-6-4-3-5-18(17)19/h3-10,12-13,20,24H,11H2,1-2H3,(H,25,28)(H,26,27,29)/t20-/m0/s1