N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-3-nitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-3-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-3-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-3-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-3-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methyl-3-nitro-benzamide Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H13N3O3S/c1-10-11(5-4-7-13(10)19(21)22)16(20)17-9-15-18-12-6-2-3-8-14(12)23-15/h2-8H,9H2,1H3,(H,17,20)