[2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonylphenyl]-thiophen-2-yl-methanone

Systemtic Name: [2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonylphenyl]-thiophen-2-yl-methanone Openeye Name: [2-[4-(4-pyridylmethyl)piperazine-1-carbonyl]phenyl]-(2-thienyl)methanone CAS Name: [2-[oxo-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methyl]phenyl]-thiophen-2-ylmethanone IUPAC Name: [2-[4-(pyridin-4-ylmethyl)piperazine-1-carbonyl]phenyl]-thiophen-2-ylmethanone Traditional Name: [2-[4-(4-pyridylmethyl)piperazine-1-carbonyl]phenyl]-(2-thienyl)methanone Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=CC=C3C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=CC=C3C(=O)C4=CC=CS4

InChI

InChI=1S/C22H21N3O2S/c26-21(20-6-3-15-28-20)18-4-1-2-5-19(18)22(27)25-13-11-24(12-14-25)16-17-7-9-23-10-8-17/h1-10,15H,11-14,16H2