(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-ethyl-N-(4-methyl-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-ethyl-N-(4-methyl-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-ethyl-N-(4-methyl-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-N-ethyl-N-(4-methyl-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)-N-ethyl-N-(4-methyl-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-ethyl-N-(4-methyl-1,3-benzothiazol-2-yl)acrylamide Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)N(CC)C2=NC3=C(C=CC=C3S2)C)C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)N(CC)C2=NC3=C(C=CC=C3S2)C)C

InChI

InChI=1S/C23H26N4OS/c1-6-11-27-16(4)12-18(17(27)5)13-19(14-24)22(28)26(7-2)23-25-21-15(3)9-8-10-20(21)29-23/h8-10,12-13H,6-7,11H2,1-5H3/b19-13+