1-[(3-ethoxyphenyl)-(4-methylthiophen-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3-ethoxyphenyl)-(4-methylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(3-ethoxyphenyl)-(4-methyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(3-ethoxyphenyl)-(4-methyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-ethoxyphenyl)-(4-methylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(4-methyl-2-thienyl)-m-phenetyl-methyl]-1,4-diazepane Formula: C19H26N2OS MolecularWeight: 330.48754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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