1-[5-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]thiophen-2-yl]ethanone

Systemtic Name: 1-[5-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]thiophen-2-yl]ethanone Openeye Name: 1-[5-(4-benzyl-1,4-diazepane-1-carbonyl)-2-thienyl]ethanone CAS Name: 1-[5-[oxo-[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]-2-thiophenyl]ethanone IUPAC Name: 1-[5-(4-benzyl-1,4-diazepane-1-carbonyl)thiophen-2-yl]ethanone Traditional Name: 1-[5-(4-benzyl-1,4-diazepane-1-carbonyl)-2-thienyl]ethanone Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H22N2O2S/c1-15(22)17-8-9-18(24-17)19(23)21-11-5-10-20(12-13-21)14-16-6-3-2-4-7-16/h2-4,6-9H,5,10-14H2,1H3