3-[(4-thiophen-2-ylthiophen-2-yl)methylamino]azepan-2-one

Systemtic Name: 3-[(4-thiophen-2-ylthiophen-2-yl)methylamino]azepan-2-one Openeye Name: 3-[[4-(2-thienyl)-2-thienyl]methylamino]azepan-2-one CAS Name: 3-[(4-thiophen-2-yl-2-thiophenyl)methylamino]-2-azepanone IUPAC Name: 3-[(4-thiophen-2-ylthiophen-2-yl)methylamino]azepan-2-one Traditional Name: 3-[[4-(2-thienyl)-2-thienyl]methylamino]azepan-2-one Formula: C15H18N2OS2 MolecularWeight: 306.44622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=CC(=CS2)C3=CC=CS3

Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=CC(=CS2)C3=CC=CS3

InChI

InChI=1S/C15H18N2OS2/c18-15-13(4-1-2-6-16-15)17-9-12-8-11(10-20-12)14-5-3-7-19-14/h3,5,7-8,10,13,17H,1-2,4,6,9H2,(H,16,18)