[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Openeye Name: (1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)-[4-(2-thienylmethyl)piperazin-1-yl]methanone CAS Name: [5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methanone IUPAC Name: (1-benzyl-5-chloro-3-methylpyrazol-4-yl)-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Traditional Name: (1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)-[4-(2-thenyl)piperazino]methanone Formula: C21H23ClN4OS MolecularWeight: 414.95152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCN(CC2)CC3=CC=CS3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCN(CC2)CC3=CC=CS3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C21H23ClN4OS/c1-16-19(20(22)26(23-16)14-17-6-3-2-4-7-17)21(27)25-11-9-24(10-12-25)15-18-8-5-13-28-18/h2-8,13H,9-12,14-15H2,1H3