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

Systemtic Name: 1-[(4-ethoxyphenyl)-thiophen-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(4-ethoxyphenyl)-(3-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(4-ethoxyphenyl)-(3-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-ethoxyphenyl)-thiophen-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[p-phenetyl(3-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=CSC=C2)N3CCCNCC3

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2OS/c1-2-21-17-6-4-15(5-7-17)18(16-8-13-22-14-16)20-11-3-9-19-10-12-20/h4-8,13-14,18-19H,2-3,9-12H2,1H3