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

Systemtic Name: 3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-yl-amino]-1-piperidin-1-yl-propan-1-one Openeye Name: 3-[isopropyl-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]amino]-1-(1-piperidyl)propan-1-one CAS Name: 3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]-1-(1-piperidinyl)-1-propanone IUPAC Name: 3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]-1-piperidin-1-ylpropan-1-one Traditional Name: 3-[isopropyl-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]amino]-1-piperidino-propan-1-one Formula: C21H30N4OS MolecularWeight: 386.5541

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NSC(=N2)N(CCC(=O)N3CCCCC3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NSC(=N2)N(CCC(=O)N3CCCCC3)C(C)C

InChI

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