(2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-(phenylmethyl)propanamide

Systemtic Name: (2S)-2-acetamido-3-(9-ethylcarbazol-3-yl)sulfanyl-N-(phenylmethyl)propanamide Openeye Name: (2S)-2-acetamido-N-benzyl-3-(9-ethylcarbazol-3-yl)sulfanyl-propanamide CAS Name: (2S)-2-acetamido-3-[(9-ethyl-3-carbazolyl)thio]-N-(phenylmethyl)propanamide IUPAC Name: (2S)-2-acetamido-N-benzyl-3-(9-ethylcarbazol-3-yl)sulfanylpropanamide Traditional Name: (2S)-2-acetamido-N-benzyl-3-[(9-ethylcarbazol-3-yl)thio]propionamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)SCC(C(=O)NCC3=CC=CC=C3)NC(=O)C)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)SC[C@H](C(=O)NCC3=CC=CC=C3)NC(=O)C)C4=CC=CC=C41

InChI

InChI=1S/C26H27N3O2S/c1-3-29-24-12-8-7-11-21(24)22-15-20(13-14-25(22)29)32-17-23(28-18(2)30)26(31)27-16-19-9-5-4-6-10-19/h4-15,23H,3,16-17H2,1-2H3,(H,27,31)(H,28,30)/t23-/m1/s1