[1-(pyridin-4-ylmethyl)piperidin-4-yl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-(pyridin-4-ylmethyl)piperidin-4-yl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: [1-(4-pyridylmethyl)-4-piperidyl]-[4-(3-thienylmethyl)piperazin-1-yl]methanone CAS Name: [1-(pyridin-4-ylmethyl)-4-piperidinyl]-[4-(3-thiophenylmethyl)-1-piperazinyl]methanone IUPAC Name: [1-(pyridin-4-ylmethyl)piperidin-4-yl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: [1-(4-pyridylmethyl)-4-piperidyl]-[4-(3-thenyl)piperazino]methanone Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CSC=C3)CC4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CSC=C3)CC4=CC=NC=C4

InChI

InChI=1S/C21H28N4OS/c26-21(25-12-10-24(11-13-25)16-19-5-14-27-17-19)20-3-8-23(9-4-20)15-18-1-6-22-7-2-18/h1-2,5-7,14,17,20H,3-4,8-13,15-16H2