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

Systemtic Name: N-butyl-3-[furan-2-ylmethyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanamide Openeye Name: N-butyl-3-[2-furylmethyl-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]amino]propanamide CAS Name: N-butyl-3-[2-furanylmethyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanamide IUPAC Name: N-butyl-3-[furan-2-ylmethyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanamide Traditional Name: N-butyl-3-[2-furfuryl-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]amino]propionamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCN(CC1=CC=CO1)C2=NC(=NS2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCCCNC(=O)CCN(CC1=CC=CO1)C2=NC(=NS2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C22H28N4O2S/c1-3-4-12-23-21(27)11-13-26(16-19-6-5-14-28-19)22-24-20(25-29-22)15-18-9-7-17(2)8-10-18/h5-10,14H,3-4,11-13,15-16H2,1-2H3,(H,23,27)