2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one Openeye Name: 2-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one CAS Name: 2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-1-(4-ethyl-1-piperazinyl)-1-propanone IUPAC Name: 2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one Traditional Name: 2-[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]-1-(4-ethylpiperazino)propan-1-one Formula: C19H27N5OS2 MolecularWeight: 405.58058

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(C)SC2=NN=C(N2C3CC3)CC4=CC=CS4

Isomeric SMILES

CCN1CCN(CC1)C(=O)C(C)SC2=NN=C(N2C3CC3)CC4=CC=CS4

InChI

InChI=1S/C19H27N5OS2/c1-3-22-8-10-23(11-9-22)18(25)14(2)27-19-21-20-17(24(19)15-6-7-15)13-16-5-4-12-26-16/h4-5,12,14-15H,3,6-11,13H2,1-2H3