1-[(4-azanyl-1,3-benzothiazol-2-yl)methyl]-4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]piperazin-2-one

Systemtic Name: 1-[(4-azanyl-1,3-benzothiazol-2-yl)methyl]-4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]piperazin-2-one Openeye Name: 1-[(4-amino-1,3-benzothiazol-2-yl)methyl]-4-(6-chlorobenzothiophen-2-yl)sulfonyl-piperazin-2-one CAS Name: 1-[(4-amino-1,3-benzothiazol-2-yl)methyl]-4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-2-piperazinone IUPAC Name: 1-[(4-amino-1,3-benzothiazol-2-yl)methyl]-4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]piperazin-2-one Traditional Name: 1-[(4-amino-1,3-benzothiazol-2-yl)methyl]-4-(6-chlorobenzothiophen-2-yl)sulfonyl-piperazin-2-one Formula: C20H17ClN4O3S3 MolecularWeight: 493.02198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)Cl)CC4=NC5=C(C=CC=C5S4)N

Isomeric SMILES

C1CN(C(=O)CN1S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)Cl)CC4=NC5=C(C=CC=C5S4)N

InChI

InChI=1S/C20H17ClN4O3S3/c21-13-5-4-12-8-19(30-16(12)9-13)31(27,28)25-7-6-24(18(26)11-25)10-17-23-20-14(22)2-1-3-15(20)29-17/h1-5,8-9H,6-7,10-11,22H2