[5-(1,3-benzothiazol-2-yl)thiophen-2-yl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [5-(1,3-benzothiazol-2-yl)thiophen-2-yl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [5-(1,3-benzothiazol-2-yl)-2-thienyl]-(4-benzylsulfonylpiperazin-1-yl)methanone CAS Name: [5-(1,3-benzothiazol-2-yl)-2-thiophenyl]-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [5-(1,3-benzothiazol-2-yl)thiophen-2-yl]-(4-benzylsulfonylpiperazin-1-yl)methanone Traditional Name: [5-(1,3-benzothiazol-2-yl)-2-thienyl]-(4-benzylsulfonylpiperazino)methanone Formula: C23H21N3O3S3 MolecularWeight: 483.62614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C23H21N3O3S3/c27-23(21-11-10-20(30-21)22-24-18-8-4-5-9-19(18)31-22)25-12-14-26(15-13-25)32(28,29)16-17-6-2-1-3-7-17/h1-11H,12-16H2