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

Systemtic Name: 1-[(4-phenylmethoxyphenyl)-thiophen-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(4-benzyloxyphenyl)-(3-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(4-phenylmethoxyphenyl)-(3-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-phenylmethoxyphenyl)-thiophen-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[(4-benzoxyphenyl)-(3-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=CSC=C4

Isomeric SMILES

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

InChI

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