(E)-3-(5-bromanylthiophen-2-yl)-2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(5-bromanylthiophen-2-yl)-2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-(5-bromo-2-thienyl)prop-2-enenitrile CAS Name: (E)-3-(5-bromo-2-thiophenyl)-2-[(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(5-bromothiophen-2-yl)-2-(2,5-dimethyl-1-prop-2-enylpyrrole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-(5-bromo-2-thienyl)acrylonitrile Formula: C17H15BrN2OS MolecularWeight: 375.2828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)C(=CC2=CC=C(S2)Br)C#N

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)/C(=C/C2=CC=C(S2)Br)/C#N

InChI

InChI=1S/C17H15BrN2OS/c1-4-7-20-11(2)8-15(12(20)3)17(21)13(10-19)9-14-5-6-16(18)22-14/h4-6,8-9H,1,7H2,2-3H3/b13-9+