(3,4-dichlorophenyl)-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (3,4-dichlorophenyl)-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (3,4-dichlorophenyl)-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (3,4-dichlorophenyl)-[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (3,4-dichlorophenyl)-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (3,4-dichlorophenyl)-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C18H14Cl2N4O3S MolecularWeight: 437.29976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14Cl2N4O3S/c19-13-3-1-11(9-14(13)20)17(25)22-5-7-23(8-6-22)18-21-15-4-2-12(24(26)27)10-16(15)28-18/h1-4,9-10H,5-8H2