(5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (5-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-(4-phenylpiperazin-1-yl)methanone CAS Name: (5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (5-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-(4-phenylpiperazino)methanone Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H26N2OS/c1-2-16-8-9-19-17(14-16)15-20(25-19)21(24)23-12-10-22(11-13-23)18-6-4-3-5-7-18/h3-7,15-16H,2,8-14H2,1H3