(2R)-N-cyclopentyl-2-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-cyclopentyl-2-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N-cyclopentyl-2-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-N-cyclopentyl-2-[[4-cyclopropyl-5-(3-indolylidene)-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-N-cyclopentyl-2-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-cyclopentyl-2-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)SC2=NNC(=C3C=NC4=CC=CC=C43)N2C5CC5

Isomeric SMILES

C[C@H](C(=O)NC1CCCC1)SC2=NNC(=C3C=NC4=CC=CC=C43)N2C5CC5

InChI

InChI=1S/C21H25N5OS/c1-13(20(27)23-14-6-2-3-7-14)28-21-25-24-19(26(21)15-10-11-15)17-12-22-18-9-5-4-8-16(17)18/h4-5,8-9,12-15,24H,2-3,6-7,10-11H2,1H3,(H,23,27)/t13-/m1/s1