[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-(2,3-dimethylquinoxalin-6-yl)methanone

Systemtic Name: [4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-(2,3-dimethylquinoxalin-6-yl)methanone Openeye Name: [4-(benzothiophen-3-ylmethyl)piperazin-1-yl]-(2,3-dimethylquinoxalin-6-yl)methanone CAS Name: [4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-(2,3-dimethyl-6-quinoxalinyl)methanone IUPAC Name: [4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-(2,3-dimethylquinoxalin-6-yl)methanone Traditional Name: [4-(benzothiophen-3-ylmethyl)piperazino]-(2,3-dimethylquinoxalin-6-yl)methanone Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CSC5=CC=CC=C54)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CSC5=CC=CC=C54)N=C1C

InChI

InChI=1S/C24H24N4OS/c1-16-17(2)26-22-13-18(7-8-21(22)25-16)24(29)28-11-9-27(10-12-28)14-19-15-30-23-6-4-3-5-20(19)23/h3-8,13,15H,9-12,14H2,1-2H3