2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylcyclohexyl)propanamide

Systemtic Name: 2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylcyclohexyl)propanamide Openeye Name: 2-[[4-(3-amino-3-oxo-propyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylcyclohexyl)propanamide CAS Name: 2-[[4-(3-amino-3-oxopropyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-N-(2-methylcyclohexyl)propanamide IUPAC Name: 2-[[4-(3-amino-3-oxopropyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylcyclohexyl)propanamide Traditional Name: 2-[[4-(3-amino-3-keto-propyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(2-methylcyclohexyl)propionamide Formula: C19H27N5O2S2 MolecularWeight: 421.57998

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(C)SC2=NN=C(N2CCC(=O)N)C3=CC=CS3

Isomeric SMILES

CC1CCCCC1NC(=O)C(C)SC2=NN=C(N2CCC(=O)N)C3=CC=CS3

InChI

InChI=1S/C19H27N5O2S2/c1-12-6-3-4-7-14(12)21-18(26)13(2)28-19-23-22-17(15-8-5-11-27-15)24(19)10-9-16(20)25/h5,8,11-14H,3-4,6-7,9-10H2,1-2H3,(H2,20,25)(H,21,26)