1-[(4,5,6-trimethoxy-1-benzothiophen-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(4,5,6-trimethoxy-1-benzothiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(4,5,6-trimethoxybenzothiophen-2-yl)methyl]-1,4-diazepane CAS Name: 1-[(4,5,6-trimethoxy-1-benzothiophen-2-yl)methyl]-1,4-diazepane IUPAC Name: 1-[(4,5,6-trimethoxy-1-benzothiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(4,5,6-trimethoxybenzothiophen-2-yl)methyl]-1,4-diazepane Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C(S2)CN3CCCNCC3)C(=C1OC)OC

Isomeric SMILES

COC1=CC2=C(C=C(S2)CN3CCCNCC3)C(=C1OC)OC

InChI

InChI=1S/C17H24N2O3S/c1-20-14-10-15-13(16(21-2)17(14)22-3)9-12(23-15)11-19-7-4-5-18-6-8-19/h9-10,18H,4-8,11H2,1-3H3