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

Systemtic Name: N-butyl-3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-yl-amino]propanamide Openeye Name: N-butyl-3-[isopropyl-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]amino]propanamide CAS Name: N-butyl-3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]propanamide IUPAC Name: N-butyl-3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]propanamide Traditional Name: N-butyl-3-[isopropyl-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]amino]propionamide Formula: C20H30N4OS MolecularWeight: 374.5434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCN(C1=NC(=NS1)CC2=CC=C(C=C2)C)C(C)C

Isomeric SMILES

CCCCNC(=O)CCN(C1=NC(=NS1)CC2=CC=C(C=C2)C)C(C)C

InChI

InChI=1S/C20H30N4OS/c1-5-6-12-21-19(25)11-13-24(15(2)3)20-22-18(23-26-20)14-17-9-7-16(4)8-10-17/h7-10,15H,5-6,11-14H2,1-4H3,(H,21,25)