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

Systemtic Name: 1-[(2-ethoxyphenyl)-(4-methylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(2-ethoxyphenyl)-(4-methyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(2-ethoxyphenyl)-(4-methyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2-ethoxyphenyl)-(4-methylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(4-methyl-2-thienyl)-o-phenetyl-methyl]-1,4-diazepane Formula: C19H26N2OS MolecularWeight: 330.48754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(C2=CC(=CS2)C)N3CCCNCC3

Isomeric SMILES

CCOC1=CC=CC=C1C(C2=CC(=CS2)C)N3CCCNCC3

InChI

InChI=1S/C19H26N2OS/c1-3-22-17-8-5-4-7-16(17)19(18-13-15(2)14-23-18)21-11-6-9-20-10-12-21/h4-5,7-8,13-14,19-20H,3,6,9-12H2,1-2H3