N-[2-[4-(4-tert-butylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-N-prop-2-enyl-4-(trifluoromethyl)benzamide

Systemtic Name: N-[2-[4-(4-tert-butylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-N-prop-2-enyl-4-(trifluoromethyl)benzamide Openeye Name: N-allyl-N-[2-[4-(4-tert-butylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]-4-(trifluoromethyl)benzamide CAS Name: N-[2-[4-(4-tert-butylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-prop-2-enyl-4-(trifluoromethyl)benzamide IUPAC Name: N-[2-[4-(4-tert-butylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-prop-2-enyl-4-(trifluoromethyl)benzamide Traditional Name: N-allyl-N-[2-[4-(4-tert-butylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-keto-ethyl]-4-(trifluoromethyl)benzamide Formula: C30H31F3N2O2S MolecularWeight: 540.63955

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2C3=C(CCN2C(=O)CN(CC=C)C(=O)C4=CC=C(C=C4)C(F)(F)F)SC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2C3=C(CCN2C(=O)CN(CC=C)C(=O)C4=CC=C(C=C4)C(F)(F)F)SC=C3

InChI

InChI=1S/C30H31F3N2O2S/c1-5-16-34(28(37)21-8-12-23(13-9-21)30(31,32)33)19-26(36)35-17-14-25-24(15-18-38-25)27(35)20-6-10-22(11-7-20)29(2,3)4/h5-13,15,18,27H,1,14,16-17,19H2,2-4H3