N-[6-[(2-methyl-3-nitro-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide

Systemtic Name: N-[6-[(2-methyl-3-nitro-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Openeye Name: N-[6-[(2-methyl-3-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide CAS Name: N-[6-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]-1,3-benzothiazol-2-yl]-2-furancarboxamide IUPAC Name: N-[6-[(2-methyl-3-nitrobenzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Traditional Name: N-[6-[(2-methyl-3-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]-2-furamide Formula: C20H14N4O5S MolecularWeight: 422.41396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C20H14N4O5S/c1-11-13(4-2-5-15(11)24(27)28)18(25)21-12-7-8-14-17(10-12)30-20(22-14)23-19(26)16-6-3-9-29-16/h2-10H,1H3,(H,21,25)(H,22,23,26)