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

Systemtic Name: 1-[(4-phenylmethoxyphenyl)-thiophen-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(4-benzyloxyphenyl)-(2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(4-phenylmethoxyphenyl)-thiophen-2-ylmethyl]-1,4-diazepane IUPAC Name: 1-[(4-phenylmethoxyphenyl)-thiophen-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[(4-benzoxyphenyl)-(2-thienyl)methyl]-1,4-diazepane Formula: C23H26N2OS MolecularWeight: 378.53034

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1CNCCN(C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C23H26N2OS/c1-2-6-19(7-3-1)18-26-21-11-9-20(10-12-21)23(22-8-4-17-27-22)25-15-5-13-24-14-16-25/h1-4,6-12,17,23-24H,5,13-16,18H2