3-[(3-methoxyphenyl)methyl]-5-(4-methylsulfonyl-1,4-diazepan-1-yl)-1,2,4-thiadiazole

Systemtic Name: 3-[(3-methoxyphenyl)methyl]-5-(4-methylsulfonyl-1,4-diazepan-1-yl)-1,2,4-thiadiazole Openeye Name: 3-[(3-methoxyphenyl)methyl]-5-(4-methylsulfonyl-1,4-diazepan-1-yl)-1,2,4-thiadiazole CAS Name: 3-[(3-methoxyphenyl)methyl]-5-(4-methylsulfonyl-1,4-diazepan-1-yl)-1,2,4-thiadiazole IUPAC Name: 3-[(3-methoxyphenyl)methyl]-5-(4-methylsulfonyl-1,4-diazepan-1-yl)-1,2,4-thiadiazole Traditional Name: 3-m-anisyl-5-(4-mesyl-1,4-diazepan-1-yl)-1,2,4-thiadiazole Formula: C16H22N4O3S2 MolecularWeight: 382.50088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O3S2/c1-23-14-6-3-5-13(11-14)12-15-17-16(24-18-15)19-7-4-8-20(10-9-19)25(2,21)22/h3,5-6,11H,4,7-10,12H2,1-2H3