(2S)-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(9-ethylcarbazol-3-yl)propanamide

Systemtic Name: (2S)-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(9-ethylcarbazol-3-yl)propanamide Openeye Name: (2S)-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(9-ethylcarbazol-3-yl)propanamide CAS Name: (2S)-2-[[4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]-N-(9-ethyl-3-carbazolyl)propanamide IUPAC Name: (2S)-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(9-ethylcarbazol-3-yl)propanamide Traditional Name: (2S)-2-[(4-cyclopropyl-5-pyrrolidino-1,2,4-triazol-3-yl)thio]-N-(9-ethylcarbazol-3-yl)propionamide Formula: C26H30N6OS MolecularWeight: 474.621

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C(C)SC3=NN=C(N3C4CC4)N5CCCC5)C6=CC=CC=C61

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)[C@H](C)SC3=NN=C(N3C4CC4)N5CCCC5)C6=CC=CC=C61

InChI

InChI=1S/C26H30N6OS/c1-3-31-22-9-5-4-8-20(22)21-16-18(10-13-23(21)31)27-24(33)17(2)34-26-29-28-25(30-14-6-7-15-30)32(26)19-11-12-19/h4-5,8-10,13,16-17,19H,3,6-7,11-12,14-15H2,1-2H3,(H,27,33)/t17-/m0/s1