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

Systemtic Name: 1-[(3-ethoxyphenyl)-thiophen-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(3-ethoxyphenyl)-(3-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(3-ethoxyphenyl)-(3-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-ethoxyphenyl)-thiophen-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[m-phenetyl(3-thienyl)methyl]-1,4-diazepane Formula: C18H24N2OS MolecularWeight: 316.46096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(C2=CSC=C2)N3CCCNCC3

Isomeric SMILES

CCOC1=CC=CC(=C1)C(C2=CSC=C2)N3CCCNCC3

InChI

InChI=1S/C18H24N2OS/c1-2-21-17-6-3-5-15(13-17)18(16-7-12-22-14-16)20-10-4-8-19-9-11-20/h3,5-7,12-14,18-19H,2,4,8-11H2,1H3