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

Systemtic Name: 1,3-benzodioxol-5-yl-(4-thieno[3,2-b]thiophen-5-ylcarbonyl-1,4-diazepan-1-yl)methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepan-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-[oxo(5-thieno[3,2-b]thiophenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepan-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepan-1-yl]methanone Formula: C20H18N2O4S2 MolecularWeight: 414.49792

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC3=C(S2)C=CS3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC3=C(S2)C=CS3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H18N2O4S2/c23-19(13-2-3-14-15(10-13)26-12-25-14)21-5-1-6-22(8-7-21)20(24)18-11-17-16(28-18)4-9-27-17/h2-4,9-11H,1,5-8,12H2