(E)-2-cyano-3-(4-nitrophenyl)-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-nitrophenyl)-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]prop-2-enamide Openeye Name: (E)-N-(5-benzylthiazol-2-yl)-2-cyano-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-nitrophenyl)-N-[5-(phenylmethyl)-2-thiazolyl]-2-propenamide IUPAC Name: (E)-N-(5-benzyl-1,3-thiazol-2-yl)-2-cyano-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(5-benzylthiazol-2-yl)-2-cyano-3-(4-nitrophenyl)acrylamide Formula: C20H14N4O3S MolecularWeight: 390.41516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C(=CC3=CC=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/C#N

InChI

InChI=1S/C20H14N4O3S/c21-12-16(10-15-6-8-17(9-7-15)24(26)27)19(25)23-20-22-13-18(28-20)11-14-4-2-1-3-5-14/h1-10,13H,11H2,(H,22,23,25)/b16-10+