N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-(2-oxidanylidenechromen-3-yl)benzamide

Systemtic Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-(2-oxidanylidenechromen-3-yl)benzamide Openeye Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-4-(2-oxochromen-3-yl)benzamide CAS Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-(2-oxo-1-benzopyran-3-yl)benzamide IUPAC Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-(2-oxochromen-3-yl)benzamide Traditional Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-4-(2-ketochromen-3-yl)benzamide Formula: C26H20N2O3S MolecularWeight: 440.5136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C26H20N2O3S/c1-15-6-11-19-21(14-27)25(32-23(19)12-15)28-24(29)17-9-7-16(8-10-17)20-13-18-4-2-3-5-22(18)31-26(20)30/h2-5,7-10,13,15H,6,11-12H2,1H3,(H,28,29)/t15-/m0/s1