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

Systemtic Name: 3-[butyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-hexyl-propanamide Openeye Name: 3-[butyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-hexyl-propanamide CAS Name: 3-[butyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-hexylpropanamide IUPAC Name: 3-[butyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-N-hexylpropanamide Traditional Name: 3-[butyl-(3-m-anisyl-1,2,4-thiadiazol-5-yl)amino]-N-hexyl-propionamide Formula: C23H36N4O2S MolecularWeight: 432.62254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CCN(CCCC)C1=NC(=NS1)CC2=CC(=CC=C2)OC

Isomeric SMILES

CCCCCCNC(=O)CCN(CCCC)C1=NC(=NS1)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C23H36N4O2S/c1-4-6-8-9-14-24-22(28)13-16-27(15-7-5-2)23-25-21(26-30-23)18-19-11-10-12-20(17-19)29-3/h10-12,17H,4-9,13-16,18H2,1-3H3,(H,24,28)