4-methyl-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carbothioamide

Systemtic Name: 4-methyl-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carbothioamide Openeye Name: N-(4-isopropylphenyl)-4-methyl-1,4-diazepane-1-carbothioamide CAS Name: 4-methyl-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carbothioamide IUPAC Name: 4-methyl-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carbothioamide Traditional Name: 4-methyl-N-p-cumenyl-1,4-diazepane-1-carbothioamide Formula: C16H25N3S MolecularWeight: 291.4548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)N2CCCN(CC2)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)N2CCCN(CC2)C

InChI

InChI=1S/C16H25N3S/c1-13(2)14-5-7-15(8-6-14)17-16(20)19-10-4-9-18(3)11-12-19/h5-8,13H,4,9-12H2,1-3H3,(H,17,20)