(4-dimethylaminophenyl)-(4-thieno[3,2-b]thiophen-5-ylcarbonyl-1,4-diazepan-1-yl)methanone

Systemtic Name: (4-dimethylaminophenyl)-(4-thieno[3,2-b]thiophen-5-ylcarbonyl-1,4-diazepan-1-yl)methanone Openeye Name: (4-dimethylaminophenyl)-[4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepan-1-yl]methanone CAS Name: (4-dimethylaminophenyl)-[4-[oxo(5-thieno[3,2-b]thiophenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (4-dimethylaminophenyl)-[4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepan-1-yl]methanone Traditional Name: (4-dimethylaminophenyl)-[4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepan-1-yl]methanone Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)N2CCCN(CC2)C(=O)C3=CC4=C(S3)C=CS4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N2CCCN(CC2)C(=O)C3=CC4=C(S3)C=CS4

InChI

InChI=1S/C21H23N3O2S2/c1-22(2)16-6-4-15(5-7-16)20(25)23-9-3-10-24(12-11-23)21(26)19-14-18-17(28-19)8-13-27-18/h4-8,13-14H,3,9-12H2,1-2H3