(2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-[2-(1H-indol-3-yl)ethyl]propanamide

Systemtic Name: (2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-[2-(1H-indol-3-yl)ethyl]propanamide Openeye Name: (2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-[2-(1H-indol-3-yl)ethyl]propanamide CAS Name: (2S)-2-acetamido-3-[(9-ethyl-3-carbazolyl)thio]-N-[2-(1H-indol-3-yl)ethyl]propanamide IUPAC Name: (2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-[2-(1H-indol-3-yl)ethyl]propanamide Traditional Name: (2S)-2-acetamido-3-[(9-ethylcarbazol-3-yl)thio]-N-[2-(1H-indol-3-yl)ethyl]propionamide Formula: C29H30N4O2S MolecularWeight: 498.6391

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)SCC(C(=O)NCCC3=CNC4=CC=CC=C43)NC(=O)C)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)SC[C@H](C(=O)NCCC3=CNC4=CC=CC=C43)NC(=O)C)C5=CC=CC=C51

InChI

InChI=1S/C29H30N4O2S/c1-3-33-27-11-7-5-9-23(27)24-16-21(12-13-28(24)33)36-18-26(32-19(2)34)29(35)30-15-14-20-17-31-25-10-6-4-8-22(20)25/h4-13,16-17,26,31H,3,14-15,18H2,1-2H3,(H,30,35)(H,32,34)/t26-/m1/s1