(2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-[(2S)-2-oxidanylpropyl]propanamide

Systemtic Name: (2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-[(2S)-2-oxidanylpropyl]propanamide Openeye Name: (2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-[(2S)-2-hydroxypropyl]propanamide CAS Name: (2S)-2-acetamido-3-[(9-ethyl-3-carbazolyl)thio]-N-[(2S)-2-hydroxypropyl]propanamide IUPAC Name: (2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-[(2S)-2-hydroxypropyl]propanamide Traditional Name: (2S)-2-acetamido-3-[(9-ethylcarbazol-3-yl)thio]-N-[(2S)-2-hydroxypropyl]propionamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)SCC(C(=O)NCC(C)O)NC(=O)C)C3=CC=CC=C31

Isomeric SMILES

CCN1C2=C(C=C(C=C2)SC[C@H](C(=O)NC[C@H](C)O)NC(=O)C)C3=CC=CC=C31

InChI

InChI=1S/C22H27N3O3S/c1-4-25-20-8-6-5-7-17(20)18-11-16(9-10-21(18)25)29-13-19(24-15(3)27)22(28)23-12-14(2)26/h5-11,14,19,26H,4,12-13H2,1-3H3,(H,23,28)(H,24,27)/t14-,19+/m0/s1