5,6-bis(2-methoxyethoxymethoxy)-4,7-bis(phenylmethyl)-1,3-diazepane-2-thione

Systemtic Name: 5,6-bis(2-methoxyethoxymethoxy)-4,7-bis(phenylmethyl)-1,3-diazepane-2-thione Openeye Name: 4,7-dibenzyl-5,6-bis(2-methoxyethoxymethoxy)-1,3-diazepane-2-thione CAS Name: 5,6-bis(2-methoxyethoxymethoxy)-4,7-bis(phenylmethyl)-1,3-diazepane-2-thione IUPAC Name: 4,7-dibenzyl-5,6-bis(2-methoxyethoxymethoxy)-1,3-diazepane-2-thione Traditional Name: 4,7-dibenzyl-5,6-bis(2-methoxyethoxymethoxy)-1,3-diazepane-2-thione Formula: C27H38N2O6S MolecularWeight: 518.66542

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCOC1C(NC(=S)NC(C1OCOCCOC)CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

COCCOCOC1C(NC(=S)NC(C1OCOCCOC)CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C27H38N2O6S/c1-30-13-15-32-19-34-25-23(17-21-9-5-3-6-10-21)28-27(36)29-24(18-22-11-7-4-8-12-22)26(25)35-20-33-16-14-31-2/h3-12,23-26H,13-20H2,1-2H3,(H2,28,29,36)