3-[4-(piperidin-1-ylmethyl)phenyl]-1H-[1]benzothiolo[3,2-c]pyrazole

Systemtic Name: 3-[4-(piperidin-1-ylmethyl)phenyl]-1H-[1]benzothiolo[3,2-c]pyrazole Openeye Name: 3-[4-(1-piperidylmethyl)phenyl]-1H-benzothiopheno[3,2-c]pyrazole CAS Name: 3-[4-(1-piperidinylmethyl)phenyl]-1H-[1]benzothiolo[3,2-c]pyrazole IUPAC Name: 3-[4-(piperidin-1-ylmethyl)phenyl]-1H-[1]benzothiolo[3,2-c]pyrazole Traditional Name: 3-[4-(piperidinomethyl)phenyl]-1H-benzothiopheno[3,2-c]pyrazole Formula: C21H21N3S MolecularWeight: 347.47654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)C3=NNC4=C3SC5=CC=CC=C54

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)C3=NNC4=C3SC5=CC=CC=C54

InChI

InChI=1S/C21H21N3S/c1-4-12-24(13-5-1)14-15-8-10-16(11-9-15)19-21-20(23-22-19)17-6-2-3-7-18(17)25-21/h2-3,6-11H,1,4-5,12-14H2,(H,22,23)