(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-6-methoxy-1-benzothiophen-2-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: (3-chloro-6-methoxy-benzothiophen-2-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone CAS Name: (3-chloro-6-methoxy-1-benzothiophen-2-yl)-[4-(4-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: (3-chloro-6-methoxy-1-benzothiophen-2-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: (3-chloro-6-methoxy-benzothiophen-2-yl)-[4-(4-methoxyphenyl)piperazino]methanone Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=C(C4=C(S3)C=C(C=C4)OC)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=C(C4=C(S3)C=C(C=C4)OC)Cl

InChI

InChI=1S/C21H21ClN2O3S/c1-26-15-5-3-14(4-6-15)23-9-11-24(12-10-23)21(25)20-19(22)17-8-7-16(27-2)13-18(17)28-20/h3-8,13H,9-12H2,1-2H3