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

Systemtic Name: 5-methyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-methyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-methyl-N-[2-(4-phenyl-1-piperazinyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-methyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: 5-methyl-N-[2-(4-phenylpiperazino)ethyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H29N3OS/c1-17-7-8-20-18(15-17)16-21(27-20)22(26)23-9-10-24-11-13-25(14-12-24)19-5-3-2-4-6-19/h2-6,16-17H,7-15H2,1H3,(H,23,26)