N-(1,3-benzothiazol-2-yl)-3-nitro-N-(phenylmethyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-nitro-N-(phenylmethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-benzyl-3-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-nitro-N-(phenylmethyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-benzyl-3-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-benzyl-3-nitro-benzamide Formula: C21H15N3O3S MolecularWeight: 389.4271

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O3S/c25-20(16-9-6-10-17(13-16)24(26)27)23(14-15-7-2-1-3-8-15)21-22-18-11-4-5-12-19(18)28-21/h1-13H,14H2