[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dinitrophenyl)methanone

Systemtic Name: [4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dinitrophenyl)methanone Openeye Name: [4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dinitrophenyl)methanone CAS Name: [4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-(3,5-dinitrophenyl)methanone IUPAC Name: [4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dinitrophenyl)methanone Traditional Name: [4-(1,3-benzothiazol-2-yl)piperazino]-(3,5-dinitrophenyl)methanone Formula: C18H15N5O5S MolecularWeight: 413.4072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H15N5O5S/c24-17(12-9-13(22(25)26)11-14(10-12)23(27)28)20-5-7-21(8-6-20)18-19-15-3-1-2-4-16(15)29-18/h1-4,9-11H,5-8H2