N-[3-[(3,4-dimethoxyphenyl)-(4-ethylpiperazin-1-yl)methyl]-5-ethyl-thiophen-2-yl]benzamide

Systemtic Name: N-[3-[(3,4-dimethoxyphenyl)-(4-ethylpiperazin-1-yl)methyl]-5-ethyl-thiophen-2-yl]benzamide Openeye Name: N-[3-[(3,4-dimethoxyphenyl)-(4-ethylpiperazin-1-yl)methyl]-5-ethyl-2-thienyl]benzamide CAS Name: N-[3-[(3,4-dimethoxyphenyl)-(4-ethyl-1-piperazinyl)methyl]-5-ethyl-2-thiophenyl]benzamide IUPAC Name: N-[3-[(3,4-dimethoxyphenyl)-(4-ethylpiperazin-1-yl)methyl]-5-ethylthiophen-2-yl]benzamide Traditional Name: N-[3-[(3,4-dimethoxyphenyl)-(4-ethylpiperazino)methyl]-5-ethyl-2-thienyl]benzamide Formula: C28H35N3O3S MolecularWeight: 493.6608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C(C3=CC(=C(C=C3)OC)OC)N4CCN(CC4)CC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C(C3=CC(=C(C=C3)OC)OC)N4CCN(CC4)CC

InChI

InChI=1S/C28H35N3O3S/c1-5-22-19-23(28(35-22)29-27(32)20-10-8-7-9-11-20)26(31-16-14-30(6-2)15-17-31)21-12-13-24(33-3)25(18-21)34-4/h7-13,18-19,26H,5-6,14-17H2,1-4H3,(H,29,32)