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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O2S/c1-21-15-4-5-16(17(12-15)22-2)18(14-6-11-23-13-14)20-9-3-7-19-8-10-20/h4-6,11-13,18-19H,3,7-10H2,1-2H3