4-methyl-N-(4-phenoxyphenyl)-1,4-diazepane-1-carbothioamide

Systemtic Name: 4-methyl-N-(4-phenoxyphenyl)-1,4-diazepane-1-carbothioamide Openeye Name: 4-methyl-N-(4-phenoxyphenyl)-1,4-diazepane-1-carbothioamide CAS Name: 4-methyl-N-(4-phenoxyphenyl)-1,4-diazepane-1-carbothioamide IUPAC Name: 4-methyl-N-(4-phenoxyphenyl)-1,4-diazepane-1-carbothioamide Traditional Name: 4-methyl-N-(4-phenoxyphenyl)-1,4-diazepane-1-carbothioamide Formula: C19H23N3OS MolecularWeight: 341.47042

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CN1CCCN(CC1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C19H23N3OS/c1-21-12-5-13-22(15-14-21)19(24)20-16-8-10-18(11-9-16)23-17-6-3-2-4-7-17/h2-4,6-11H,5,12-15H2,1H3,(H,20,24)