2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(4-butylphenyl)butanamide

Systemtic Name: 2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(4-butylphenyl)butanamide Openeye Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(4-butylphenyl)butanamide CAS Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-(4-butylphenyl)butanamide IUPAC Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(4-butylphenyl)butanamide Traditional Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-(4-butylphenyl)butyramide Formula: C18H27N5OS MolecularWeight: 361.50488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(CC)N2C(=NN=C2SCC)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C(CC)N2C(=NN=C2SCC)N

InChI

InChI=1S/C18H27N5OS/c1-4-7-8-13-9-11-14(12-10-13)20-16(24)15(5-2)23-17(19)21-22-18(23)25-6-3/h9-12,15H,4-8H2,1-3H3,(H2,19,21)(H,20,24)