2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-6-nitro-1,3-benzothiazole

Systemtic Name: 2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-6-nitro-1,3-benzothiazole Openeye Name: 2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-6-nitro-1,3-benzothiazole CAS Name: 2-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-6-nitro-1,3-benzothiazole Traditional Name: 2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-6-nitro-1,3-benzothiazole Formula: C15H13ClN4O4S3 MolecularWeight: 444.93612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C15H13ClN4O4S3/c16-13-3-4-14(26-13)27(23,24)19-7-5-18(6-8-19)15-17-11-2-1-10(20(21)22)9-12(11)25-15/h1-4,9H,5-8H2