(3-chloranyl-6-methyl-1-benzothiophen-2-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-6-methyl-1-benzothiophen-2-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-(3-chloro-6-methyl-benzothiophen-2-yl)methanone CAS Name: (3-chloro-6-methyl-1-benzothiophen-2-yl)-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(3-chloro-6-methyl-1-benzothiophen-2-yl)methanone Traditional Name: (4-benzylpiperazino)-(3-chloro-6-methyl-benzothiophen-2-yl)methanone Formula: C21H21ClN2OS MolecularWeight: 384.92224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C(=O)N3CCN(CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C(=O)N3CCN(CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C21H21ClN2OS/c1-15-7-8-17-18(13-15)26-20(19(17)22)21(25)24-11-9-23(10-12-24)14-16-5-3-2-4-6-16/h2-8,13H,9-12,14H2,1H3