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

Systemtic Name: 5-methyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-methyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-methyl-N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-methyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: 5-methyl-N-[2-methyl-4-(4-methylpiperazino)phenyl]-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)NC3=C(C=C(C=C3)N4CCN(CC4)C)C

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NC3=C(C=C(C=C3)N4CCN(CC4)C)C

InChI

InChI=1S/C22H29N3OS/c1-15-4-7-20-17(12-15)14-21(27-20)22(26)23-19-6-5-18(13-16(19)2)25-10-8-24(3)9-11-25/h5-6,13-15H,4,7-12H2,1-3H3,(H,23,26)