3-[butyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-phenethyl-propanamide

Systemtic Name: 3-[butyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-phenethyl-propanamide Openeye Name: 3-[butyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-phenethyl-propanamide CAS Name: 3-[butyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-phenethylpropanamide IUPAC Name: 3-[butyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-phenethylpropanamide Traditional Name: 3-[butyl-(3-m-anisyl-1,2,4-thiadiazol-5-yl)amino]-N-phenethyl-propionamide Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)NCCC1=CC=CC=C1)C2=NC(=NS2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCCCN(CCC(=O)NCCC1=CC=CC=C1)C2=NC(=NS2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C25H32N4O2S/c1-3-4-16-29(17-14-24(30)26-15-13-20-9-6-5-7-10-20)25-27-23(28-32-25)19-21-11-8-12-22(18-21)31-2/h5-12,18H,3-4,13-17,19H2,1-2H3,(H,26,30)