4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-phenyl-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-phenyl-1,4-diazepane-1-carboxamide Openeye Name: 4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-phenyl-1,4-diazepane-1-carboxamide CAS Name: 4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-phenyl-1,4-diazepane-1-carboxamide IUPAC Name: 4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-phenyl-1,4-diazepane-1-carboxamide Traditional Name: 4-(3-m-anisyl-1,2,4-thiadiazol-5-yl)-N-phenyl-1,4-diazepane-1-carboxamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2=NSC(=N2)N3CCCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)CC2=NSC(=N2)N3CCCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H25N5O2S/c1-29-19-10-5-7-17(15-19)16-20-24-22(30-25-20)27-12-6-11-26(13-14-27)21(28)23-18-8-3-2-4-9-18/h2-5,7-10,15H,6,11-14,16H2,1H3,(H,23,28)