[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone

Systemtic Name: [4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone Openeye Name: [4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]-(3-pyrrol-1-yl-2-thienyl)methanone CAS Name: [4-[(4-ethoxyphenyl)methyl]-1-piperazinyl]-[3-(1-pyrrolyl)-2-thiophenyl]methanone IUPAC Name: [4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone Traditional Name: [4-(4-ethoxybenzyl)piperazino]-(3-pyrrol-1-yl-2-thienyl)methanone Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=C(C=CS3)N4C=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=C(C=CS3)N4C=CC=C4

InChI

InChI=1S/C22H25N3O2S/c1-2-27-19-7-5-18(6-8-19)17-23-12-14-25(15-13-23)22(26)21-20(9-16-28-21)24-10-3-4-11-24/h3-11,16H,2,12-15,17H2,1H3