2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(1-naphthalen-2-ylethyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(1-naphthalen-2-ylethyl)ethanamide Openeye Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[1-(2-naphthyl)ethyl]acetamide CAS Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-[1-(2-naphthalenyl)ethyl]acetamide IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(1-naphthalen-2-ylethyl)acetamide Traditional Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-[1-(2-naphthyl)ethyl]acetamide Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2C=C1)NC(=O)CSC3=NN=C(N3N)C4CCCCC4

Isomeric SMILES

CC(C1=CC2=CC=CC=C2C=C1)NC(=O)CSC3=NN=C(N3N)C4CCCCC4

InChI

InChI=1S/C22H27N5OS/c1-15(18-12-11-16-7-5-6-10-19(16)13-18)24-20(28)14-29-22-26-25-21(27(22)23)17-8-3-2-4-9-17/h5-7,10-13,15,17H,2-4,8-9,14,23H2,1H3,(H,24,28)