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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O3S/c1-3-28-20-9-8-17(14-21(20)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