1-(4-ethanoylpiperazin-1-yl)-3-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-propan-2-yl-amino]propan-1-one

Systemtic Name: 1-(4-ethanoylpiperazin-1-yl)-3-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-propan-2-yl-amino]propan-1-one Openeye Name: 1-(4-acetylpiperazin-1-yl)-3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-isopropyl-amino]propan-1-one CAS Name: 1-(4-acetyl-1-piperazinyl)-3-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]-1-propanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-propan-2-ylamino]propan-1-one Traditional Name: 1-(4-acetylpiperazino)-3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-isopropyl-amino]propan-1-one Formula: C21H29N5O2S MolecularWeight: 415.55226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCC(=O)N1CCN(CC1)C(=O)C)C2=NC(=NS2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)N(CCC(=O)N1CCN(CC1)C(=O)C)C2=NC(=NS2)CC3=CC=CC=C3

InChI

InChI=1S/C21H29N5O2S/c1-16(2)26(10-9-20(28)25-13-11-24(12-14-25)17(3)27)21-22-19(23-29-21)15-18-7-5-4-6-8-18/h4-8,16H,9-15H2,1-3H3