3-azanyl-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-7-methyl-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: 3-amino-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-7-methylthieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide Formula: C26H26N4OS2 MolecularWeight: 474.64084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC3=C(C=C2C=C1)C(=C(S3)C(=O)NC4=C(C5=C(S4)CC(CC5)C(C)(C)C)C#N)N

Isomeric SMILES

CC1=CC2=NC3=C(C=C2C=C1)C(=C(S3)C(=O)NC4=C(C5=C(S4)CC(CC5)C(C)(C)C)C#N)N

InChI

InChI=1S/C26H26N4OS2/c1-13-5-6-14-10-17-21(28)22(33-24(17)29-19(14)9-13)23(31)30-25-18(12-27)16-8-7-15(26(2,3)4)11-20(16)32-25/h5-6,9-10,15H,7-8,11,28H2,1-4H3,(H,30,31)