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

Systemtic Name: 1-[(4-ethoxyphenyl)-thiophen-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(4-ethoxyphenyl)-(2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(4-ethoxyphenyl)-thiophen-2-ylmethyl]-1,4-diazepane IUPAC Name: 1-[(4-ethoxyphenyl)-thiophen-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[p-phenetyl(2-thienyl)methyl]-1,4-diazepane Formula: C18H24N2OS MolecularWeight: 316.46096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C2=CC=CS2)N3CCCNCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C2=CC=CS2)N3CCCNCC3

InChI

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