3-(3-bromanyl-4-butan-2-yloxy-phenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide

Systemtic Name: 3-(3-bromanyl-4-butan-2-yloxy-phenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide Openeye Name: 3-(3-bromo-4-sec-butoxy-phenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)prop-2-enamide CAS Name: 3-(3-bromo-4-butan-2-yloxyphenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-propenamide IUPAC Name: 3-(3-bromo-4-butan-2-yloxyphenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide Traditional Name: 3-(3-bromo-4-sec-butoxy-phenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acrylamide Formula: C23H22BrN3O2S MolecularWeight: 484.40868

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)Br

Isomeric SMILES

CCC(C)OC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)Br

InChI

InChI=1S/C23H22BrN3O2S/c1-3-14(2)29-20-9-8-15(11-19(20)24)10-16(12-25)22(28)27-23-18(13-26)17-6-4-5-7-21(17)30-23/h8-11,14H,3-7H2,1-2H3,(H,27,28)