N-(cyclopropylmethyl)-2-[(3-methylphenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)propanamide

Systemtic Name: N-(cyclopropylmethyl)-2-[(3-methylphenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)propanamide Openeye Name: N-(cyclopropylmethyl)-2-(m-tolylmethylsulfanyl)-N-(1H-1,2,4-triazol-5-yl)propanamide CAS Name: N-(cyclopropylmethyl)-2-[(3-methylphenyl)methylthio]-N-(1H-1,2,4-triazol-5-yl)propanamide IUPAC Name: N-(cyclopropylmethyl)-2-[(3-methylphenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)propanamide Traditional Name: N-(cyclopropylmethyl)-2-[(3-methylbenzyl)thio]-N-(1H-1,2,4-triazol-5-yl)propionamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC(C)C(=O)N(CC2CC2)C3=NC=NN3

Isomeric SMILES

CC1=CC(=CC=C1)CSC(C)C(=O)N(CC2CC2)C3=NC=NN3

InChI

InChI=1S/C17H22N4OS/c1-12-4-3-5-15(8-12)10-23-13(2)16(22)21(9-14-6-7-14)17-18-11-19-20-17/h3-5,8,11,13-14H,6-7,9-10H2,1-2H3,(H,18,19,20)