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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)C4=NSC5=CC=CC=C54

Isomeric SMILES

CC1=C(C=C(O1)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)C4=NSC5=CC=CC=C54

InChI

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