N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)-2-methyl-phenyl]-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C23H31N3OS MolecularWeight: 397.57674

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC4=C(S3)CCC(C4)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC4=C(S3)CCC(C4)C)C

InChI

InChI=1S/C23H31N3OS/c1-4-25-9-11-26(12-10-25)19-6-7-20(17(3)14-19)24-23(27)22-15-18-13-16(2)5-8-21(18)28-22/h6-7,14-16H,4-5,8-13H2,1-3H3,(H,24,27)