4-methylidene-N-(phenylmethyl)-2-sulfanylidene-6-thiophen-2-yl-1,3-diazinane-5-carboxamide

Systemtic Name: 4-methylidene-N-(phenylmethyl)-2-sulfanylidene-6-thiophen-2-yl-1,3-diazinane-5-carboxamide Openeye Name: N-benzyl-4-methylene-6-(2-thienyl)-2-thioxo-hexahydropyrimidine-5-carboxamide CAS Name: 4-methylene-N-(phenylmethyl)-2-sulfanylidene-6-thiophen-2-yl-1,3-diazinane-5-carboxamide IUPAC Name: N-benzyl-4-methylidene-2-sulfanylidene-6-thiophen-2-yl-1,3-diazinane-5-carboxamide Traditional Name: N-benzyl-4-methylene-6-(2-thienyl)-2-thioxo-hexahydropyrimidine-5-carboxamide Formula: C17H17N3OS2 MolecularWeight: 343.46638

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(NC(=S)N1)C2=CC=CS2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C=C1C(C(NC(=S)N1)C2=CC=CS2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C17H17N3OS2/c1-11-14(16(21)18-10-12-6-3-2-4-7-12)15(20-17(22)19-11)13-8-5-9-23-13/h2-9,14-15H,1,10H2,(H,18,21)(H2,19,20,22)