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

Systemtic Name: 3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-yl-amino]-N-phenethyl-propanamide Openeye Name: 3-[isopropyl-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]amino]-N-phenethyl-propanamide CAS Name: 3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]-N-phenethylpropanamide IUPAC Name: 3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]-N-phenethylpropanamide Traditional Name: 3-[isopropyl-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]amino]-N-phenethyl-propionamide Formula: C24H30N4OS MolecularWeight: 422.5862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NSC(=N2)N(CCC(=O)NCCC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NSC(=N2)N(CCC(=O)NCCC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C24H30N4OS/c1-18(2)28(16-14-23(29)25-15-13-20-7-5-4-6-8-20)24-26-22(27-30-24)17-21-11-9-19(3)10-12-21/h4-12,18H,13-17H2,1-3H3,(H,25,29)