[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: [3-ethoxy-4-(3-pyridylmethoxy)phenyl]-[4-(3-thienylmethyl)piperazin-1-yl]methanone CAS Name: [3-ethoxy-4-(3-pyridinylmethoxy)phenyl]-[4-(3-thiophenylmethyl)-1-piperazinyl]methanone IUPAC Name: [3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: [3-ethoxy-4-(3-pyridylmethoxy)phenyl]-[4-(3-thenyl)piperazino]methanone Formula: C24H27N3O3S MolecularWeight: 437.55448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CSC=C3)OCC4=CN=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CSC=C3)OCC4=CN=CC=C4

InChI

InChI=1S/C24H27N3O3S/c1-2-29-23-14-21(5-6-22(23)30-17-19-4-3-8-25-15-19)24(28)27-11-9-26(10-12-27)16-20-7-13-31-18-20/h3-8,13-15,18H,2,9-12,16-17H2,1H3