3-[(3-methoxyphenyl)methyl]-N-(4-phenylbutan-2-yl)-1,2,4-thiadiazol-5-amine

Systemtic Name: 3-[(3-methoxyphenyl)methyl]-N-(4-phenylbutan-2-yl)-1,2,4-thiadiazol-5-amine Openeye Name: 3-[(3-methoxyphenyl)methyl]-N-(1-methyl-3-phenyl-propyl)-1,2,4-thiadiazol-5-amine CAS Name: 3-[(3-methoxyphenyl)methyl]-N-(4-phenylbutan-2-yl)-1,2,4-thiadiazol-5-amine IUPAC Name: 3-[(3-methoxyphenyl)methyl]-N-(4-phenylbutan-2-yl)-1,2,4-thiadiazol-5-amine Traditional Name: (3-m-anisyl-1,2,4-thiadiazol-5-yl)-(1-methyl-3-phenyl-propyl)amine Formula: C20H23N3OS MolecularWeight: 353.48112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC2=NC(=NS2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC2=NC(=NS2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H23N3OS/c1-15(11-12-16-7-4-3-5-8-16)21-20-22-19(23-25-20)14-17-9-6-10-18(13-17)24-2/h3-10,13,15H,11-12,14H2,1-2H3,(H,21,22,23)