N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-methyl-2-nitro-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H15N3O3S/c1-13-7-6-9-15(19(13)24(26)27)20(25)22-16-10-3-2-8-14(16)21-23-17-11-4-5-12-18(17)28-21/h2-12H,1H3,(H,22,25)