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

Systemtic Name: [4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-(4-methoxyphenyl)methanone Openeye Name: [4-(3-chlorobenzothiophene-2-carbonyl)piperazin-1-yl]-(4-methoxyphenyl)methanone CAS Name: [4-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]-(4-methoxyphenyl)methanone IUPAC Name: [4-(3-chloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]-(4-methoxyphenyl)methanone Traditional Name: [4-(3-chlorobenzothiophene-2-carbonyl)piperazino]-(4-methoxyphenyl)methanone Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H19ClN2O3S/c1-27-15-8-6-14(7-9-15)20(25)23-10-12-24(13-11-23)21(26)19-18(22)16-4-2-3-5-17(16)28-19/h2-9H,10-13H2,1H3