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

Systemtic Name: 5,6-bis(oxidanyl)-1,3,4,7-tetrakis(phenylmethyl)-1,3-diazepane-2-thione Openeye Name: 1,3,4,7-tetrabenzyl-5,6-dihydroxy-1,3-diazepane-2-thione CAS Name: 5,6-dihydroxy-1,3,4,7-tetrakis(phenylmethyl)-1,3-diazepane-2-thione IUPAC Name: 1,3,4,7-tetrabenzyl-5,6-dihydroxy-1,3-diazepane-2-thione Traditional Name: 1,3,4,7-tetrabenzyl-5,6-dihydroxy-1,3-diazepane-2-thione Formula: C33H34N2O2S MolecularWeight: 522.70026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(C(C(N(C(=S)N2CC3=CC=CC=C3)CC4=CC=CC=C4)CC5=CC=CC=C5)O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2C(C(C(N(C(=S)N2CC3=CC=CC=C3)CC4=CC=CC=C4)CC5=CC=CC=C5)O)O

InChI

InChI=1S/C33H34N2O2S/c36-31-29(21-25-13-5-1-6-14-25)34(23-27-17-9-3-10-18-27)33(38)35(24-28-19-11-4-12-20-28)30(32(31)37)22-26-15-7-2-8-16-26/h1-20,29-32,36-37H,21-24H2