N-(2-cyanophenyl)-4-thieno[3,2-b]thiophen-5-ylcarbonyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-(2-cyanophenyl)-4-thieno[3,2-b]thiophen-5-ylcarbonyl-1,4-diazepane-1-carboxamide Openeye Name: N-(2-cyanophenyl)-4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepane-1-carboxamide CAS Name: N-(2-cyanophenyl)-4-[oxo(5-thieno[3,2-b]thiophenyl)methyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(2-cyanophenyl)-4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(2-cyanophenyl)-4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepane-1-carboxamide Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NC2=CC=CC=C2C#N)C(=O)C3=CC4=C(S3)C=CS4

Isomeric SMILES

C1CN(CCN(C1)C(=O)NC2=CC=CC=C2C#N)C(=O)C3=CC4=C(S3)C=CS4

InChI

InChI=1S/C20H18N4O2S2/c21-13-14-4-1-2-5-15(14)22-20(26)24-8-3-7-23(9-10-24)19(25)18-12-17-16(28-18)6-11-27-17/h1-2,4-6,11-12H,3,7-10H2,(H,22,26)