2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methyl-1-phenyl-butyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methyl-1-phenyl-butyl)ethanamide Openeye Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methyl-1-phenyl-butyl)acetamide CAS Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(3-methyl-1-phenylbutyl)acetamide IUPAC Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methyl-1-phenylbutyl)acetamide Traditional Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(3-methyl-1-phenyl-butyl)acetamide Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)NC(=O)CSC2=NN=C(N2N)C3CC3

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)NC(=O)CSC2=NN=C(N2N)C3CC3

InChI

InChI=1S/C18H25N5OS/c1-12(2)10-15(13-6-4-3-5-7-13)20-16(24)11-25-18-22-21-17(23(18)19)14-8-9-14/h3-7,12,14-15H,8-11,19H2,1-2H3,(H,20,24)