(E)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-(5-nitrothiophen-2-yl)prop-2-enamide

Systemtic Name: (E)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-(5-nitrothiophen-2-yl)prop-2-enamide Openeye Name: (E)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-(5-nitro-2-thienyl)prop-2-enamide CAS Name: (E)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-(5-nitro-2-thiophenyl)-2-propenamide IUPAC Name: (E)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-(5-nitrothiophen-2-yl)prop-2-enamide Traditional Name: (E)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-(5-nitro-2-thienyl)acrylamide Formula: C16H13N3O3S2 MolecularWeight: 359.42272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)NC(=O)C=CC3=CC=C(S3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)NC(=O)/C=C/C3=CC=C(S3)[N+](=O)[O-])C

InChI

InChI=1S/C16H13N3O3S2/c1-9-7-10(2)15-12(8-9)17-16(24-15)18-13(20)5-3-11-4-6-14(23-11)19(21)22/h3-8H,1-2H3,(H,17,18,20)/b5-3+