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

Systemtic Name: 1-[(3,4-dimethoxyphenyl)-thiophen-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(3,4-dimethoxyphenyl)-(3-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(3,4-dimethoxyphenyl)-(3-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3,4-dimethoxyphenyl)-thiophen-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[(3,4-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=C(C=C1)C(C2=CSC=C2)N3CCCNCC3)OC

Isomeric SMILES

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

InChI

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