4-[5-(phenylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]butanoic acid

Systemtic Name: 4-[5-(phenylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]butanoic acid Openeye Name: 4-(5-benzyl-6-thioxo-1,3,5-thiadiazinan-3-yl)butanoic acid CAS Name: 4-[5-(phenylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]butanoic acid IUPAC Name: 4-(5-benzyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)butanoic acid Traditional Name: 4-(5-benzyl-6-thioxo-1,3,5-thiadiazinan-3-yl)butyric acid Formula: C14H18N2O2S2 MolecularWeight: 310.43492

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Descriptors Computed from Structure

Canonical SMILES:

C1N(CSC(=S)N1CC2=CC=CC=C2)CCCC(=O)O

Isomeric SMILES

C1N(CSC(=S)N1CC2=CC=CC=C2)CCCC(=O)O

InChI

InChI=1S/C14H18N2O2S2/c17-13(18)7-4-8-15-10-16(14(19)20-11-15)9-12-5-2-1-3-6-12/h1-3,5-6H,4,7-11H2,(H,17,18)