N-tert-butyl-3-chloranyl-7-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]-1-benzothiophene-2-carboxamide

Systemtic Name: N-tert-butyl-3-chloranyl-7-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]-1-benzothiophene-2-carboxamide Openeye Name: N-tert-butyl-3-chloro-7-[[(E)-3-(4-isopropylphenyl)prop-2-enoyl]amino]benzothiophene-2-carboxamide CAS Name: N-tert-butyl-3-chloro-7-[[(E)-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]-1-benzothiophene-2-carboxamide IUPAC Name: N-tert-butyl-3-chloro-7-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]-1-benzothiophene-2-carboxamide Traditional Name: N-tert-butyl-3-chloro-7-[[(E)-3-p-cumenylacryloyl]amino]benzothiophene-2-carboxamide Formula: C25H27ClN2O2S MolecularWeight: 455.01208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)NC2=CC=CC3=C2SC(=C3Cl)C(=O)NC(C)(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/C(=O)NC2=CC=CC3=C2SC(=C3Cl)C(=O)NC(C)(C)C

InChI

InChI=1S/C25H27ClN2O2S/c1-15(2)17-12-9-16(10-13-17)11-14-20(29)27-19-8-6-7-18-21(26)23(31-22(18)19)24(30)28-25(3,4)5/h6-15H,1-5H3,(H,27,29)(H,28,30)/b14-11+