1-[(2,6-dimethoxyphenyl)-thiophen-3-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-thiophen-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(2,6-dimethoxyphenyl)-(3-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(2,6-dimethoxyphenyl)-(3-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2,6-dimethoxyphenyl)-thiophen-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[(2,6-dimethoxyphenyl)-(3-thienyl)methyl]-1,4-diazepane Formula: C18H24N2O2S MolecularWeight: 332.46036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(C2=CSC=C2)N3CCCNCC3

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(C2=CSC=C2)N3CCCNCC3

InChI

InChI=1S/C18H24N2O2S/c1-21-15-5-3-6-16(22-2)17(15)18(14-7-12-23-13-14)20-10-4-8-19-9-11-20/h3,5-7,12-13,18-19H,4,8-11H2,1-2H3