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

Systemtic Name: 3-[butyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-1-morpholin-4-yl-propan-1-one Openeye Name: 3-[butyl-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]amino]-1-morpholino-propan-1-one CAS Name: 3-[butyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-1-(4-morpholinyl)-1-propanone IUPAC Name: 3-[butyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-1-morpholin-4-ylpropan-1-one Traditional Name: 3-[butyl-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]amino]-1-morpholino-propan-1-one Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)N1CCOCC1)C2=NC(=NS2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCCCN(CCC(=O)N1CCOCC1)C2=NC(=NS2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C21H30N4O2S/c1-3-4-10-25(11-9-20(26)24-12-14-27-15-13-24)21-22-19(23-28-21)16-18-7-5-17(2)6-8-18/h5-8H,3-4,9-16H2,1-2H3