[4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone

Systemtic Name: [4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone Openeye Name: [4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)phenyl]-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone CAS Name: [4-(4-chloro-3,5-dimethyl-1-pyrazolyl)phenyl]-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methanone IUPAC Name: [4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone Traditional Name: [4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)phenyl]-[4-(2-thenoyl)piperazino]methanone Formula: C21H21ClN4O2S MolecularWeight: 428.93504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CS4)C)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CS4)C)Cl

InChI

InChI=1S/C21H21ClN4O2S/c1-14-19(22)15(2)26(23-14)17-7-5-16(6-8-17)20(27)24-9-11-25(12-10-24)21(28)18-4-3-13-29-18/h3-8,13H,9-12H2,1-2H3