(2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-(2-pyrrolidin-1-ylethyl)propanamide

Systemtic Name: (2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-(2-pyrrolidin-1-ylethyl)propanamide Openeye Name: (2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-(2-pyrrolidin-1-ylethyl)propanamide CAS Name: (2S)-2-acetamido-3-[(9-ethyl-3-carbazolyl)thio]-N-[2-(1-pyrrolidinyl)ethyl]propanamide IUPAC Name: (2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-(2-pyrrolidin-1-ylethyl)propanamide Traditional Name: (2S)-2-acetamido-3-[(9-ethylcarbazol-3-yl)thio]-N-(2-pyrrolidinoethyl)propionamide Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)SCC(C(=O)NCCN3CCCC3)NC(=O)C)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)SC[C@H](C(=O)NCCN3CCCC3)NC(=O)C)C4=CC=CC=C41

InChI

InChI=1S/C25H32N4O2S/c1-3-29-23-9-5-4-8-20(23)21-16-19(10-11-24(21)29)32-17-22(27-18(2)30)25(31)26-12-15-28-13-6-7-14-28/h4-5,8-11,16,22H,3,6-7,12-15,17H2,1-2H3,(H,26,31)(H,27,30)/t22-/m1/s1