[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-(3-ethoxy-4-methoxy-phenyl)methanone

Systemtic Name: [4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-(3-ethoxy-4-methoxy-phenyl)methanone Openeye Name: [4-(benzothiophen-3-ylmethyl)piperazin-1-yl]-(3-ethoxy-4-methoxy-phenyl)methanone CAS Name: [4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-(3-ethoxy-4-methoxyphenyl)methanone IUPAC Name: [4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-(3-ethoxy-4-methoxyphenyl)methanone Traditional Name: [4-(benzothiophen-3-ylmethyl)piperazino]-(3-ethoxy-4-methoxy-phenyl)methanone Formula: C23H26N2O3S MolecularWeight: 410.52914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CSC4=CC=CC=C43)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CSC4=CC=CC=C43)OC

InChI

InChI=1S/C23H26N2O3S/c1-3-28-21-14-17(8-9-20(21)27-2)23(26)25-12-10-24(11-13-25)15-18-16-29-22-7-5-4-6-19(18)22/h4-9,14,16H,3,10-13,15H2,1-2H3