N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-nitro-benzamide

Systemtic Name: N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-nitro-benzamide Openeye Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-3-nitro-benzamide CAS Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-nitrobenzamide IUPAC Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-nitrobenzamide Traditional Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-3-nitro-benzamide Formula: C20H14ClN3O4S MolecularWeight: 427.86086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CO3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CO3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H14ClN3O4S/c1-12-7-8-16(21)18-17(12)22-20(29-18)23(11-15-6-3-9-28-15)19(25)13-4-2-5-14(10-13)24(26)27/h2-10H,11H2,1H3