N-(2-methoxyphenyl)-4-methyl-1,4-diazepane-1-carbothioamide

Systemtic Name: N-(2-methoxyphenyl)-4-methyl-1,4-diazepane-1-carbothioamide Openeye Name: N-(2-methoxyphenyl)-4-methyl-1,4-diazepane-1-carbothioamide CAS Name: N-(2-methoxyphenyl)-4-methyl-1,4-diazepane-1-carbothioamide IUPAC Name: N-(2-methoxyphenyl)-4-methyl-1,4-diazepane-1-carbothioamide Traditional Name: N-(2-methoxyphenyl)-4-methyl-1,4-diazepane-1-carbothioamide Formula: C14H21N3OS MolecularWeight: 279.40104

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=S)NC2=CC=CC=C2OC

Isomeric SMILES

CN1CCCN(CC1)C(=S)NC2=CC=CC=C2OC

InChI

InChI=1S/C14H21N3OS/c1-16-8-5-9-17(11-10-16)14(19)15-12-6-3-4-7-13(12)18-2/h3-4,6-7H,5,8-11H2,1-2H3,(H,15,19)