[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-(4-methoxy-1-phenyl-pyrazol-3-yl)methanone

Systemtic Name: [4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-(4-methoxy-1-phenyl-pyrazol-3-yl)methanone Openeye Name: [4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]-(4-methoxy-1-phenyl-pyrazol-3-yl)methanone CAS Name: [4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-(4-methoxy-1-phenyl-3-pyrazolyl)methanone IUPAC Name: [4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]-(4-methoxy-1-phenylpyrazol-3-yl)methanone Traditional Name: [4-[(5-chloro-2-thienyl)methyl]piperazino]-(4-methoxy-1-phenyl-pyrazol-3-yl)methanone Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)N2CCN(CC2)CC3=CC=C(S3)Cl)C4=CC=CC=C4

Isomeric SMILES

COC1=CN(N=C1C(=O)N2CCN(CC2)CC3=CC=C(S3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H21ClN4O2S/c1-27-17-14-25(15-5-3-2-4-6-15)22-19(17)20(26)24-11-9-23(10-12-24)13-16-7-8-18(21)28-16/h2-8,14H,9-13H2,1H3