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

Systemtic Name: (2S)-N-(9-ethylcarbazol-3-yl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2S)-N-(9-ethylcarbazol-3-yl)-2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2S)-N-(9-ethyl-3-carbazolyl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2S)-N-(9-ethylcarbazol-3-yl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2S)-N-(9-ethylcarbazol-3-yl)-2-[(4-isopropyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C(C)SC3=NN=CN3C(C)C)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)[C@H](C)SC3=NN=CN3C(C)C)C4=CC=CC=C41

InChI

InChI=1S/C22H25N5OS/c1-5-26-19-9-7-6-8-17(19)18-12-16(10-11-20(18)26)24-21(28)15(4)29-22-25-23-13-27(22)14(2)3/h6-15H,5H2,1-4H3,(H,24,28)/t15-/m0/s1