N-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-1-carbothioamide

Systemtic Name: N-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-1-carbothioamide Openeye Name: N-benzyl-2-thioxo-hexahydropyrimidine-1-carbothioamide CAS Name: N-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-1-carbothioamide IUPAC Name: N-benzyl-2-sulfanylidene-1,3-diazinane-1-carbothioamide Traditional Name: N-benzyl-2-thioxo-hexahydropyrimidine-1-carbothioamide Formula: C12H15N3S2 MolecularWeight: 265.3976

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=S)N(C1)C(=S)NCC2=CC=CC=C2

Isomeric SMILES

C1CNC(=S)N(C1)C(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C12H15N3S2/c16-11-13-7-4-8-15(11)12(17)14-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,13,16)(H,14,17)