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

Systemtic Name: 3-[butyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[butyl-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]amino]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[butyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[butyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[butyl-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]amino]-1-pyrrolidino-propan-1-one Formula: C21H30N4OS MolecularWeight: 386.5541

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)N1CCCC1)C2=NC(=NS2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCCCN(CCC(=O)N1CCCC1)C2=NC(=NS2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C21H30N4OS/c1-3-4-12-25(15-11-20(26)24-13-5-6-14-24)21-22-19(23-27-21)16-18-9-7-17(2)8-10-18/h7-10H,3-6,11-16H2,1-2H3