(5-oxidanylidene-5-phenylazanyl-pentyl)carbamothioic S-acid

Systemtic Name: (5-oxidanylidene-5-phenylazanyl-pentyl)carbamothioic S-acid Openeye Name: (5-anilino-5-oxo-pentyl)carbamothioic S-acid CAS Name: (5-anilino-5-oxopentyl)carbamothioic S-acid IUPAC Name: (5-anilino-5-oxopentyl)carbamothioic S-acid Traditional Name: (5-anilino-5-keto-pentyl)thiocarbamic S-acid Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCCCNC(=O)S

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCCCNC(=O)S

InChI

InChI=1S/C12H16N2O2S/c15-11(8-4-5-9-13-12(16)17)14-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,14,15)(H2,13,16,17)