[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[5-(4-methyl-2-nitro-phenyl)furan-2-yl]methanone

Systemtic Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[5-(4-methyl-2-nitro-phenyl)furan-2-yl]methanone Openeye Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[5-(4-methyl-2-nitro-phenyl)-2-furyl]methanone CAS Name: [4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-[5-(4-methyl-2-nitrophenyl)-2-furanyl]methanone IUPAC Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[5-(4-methyl-2-nitrophenyl)furan-2-yl]methanone Traditional Name: [4-(1,2-benzothiazol-3-yl)piperazino]-[5-(4-methyl-2-nitro-phenyl)-2-furyl]methanone Formula: C23H20N4O4S MolecularWeight: 448.4943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=C(O2)C(=O)N3CCN(CC3)C4=NSC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=C(O2)C(=O)N3CCN(CC3)C4=NSC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C23H20N4O4S/c1-15-6-7-16(18(14-15)27(29)30)19-8-9-20(31-19)23(28)26-12-10-25(11-13-26)22-17-4-2-3-5-21(17)32-24-22/h2-9,14H,10-13H2,1H3