bis(azanyl)methylidene-[(5S)-4-oxidanylidene-5-(2-oxidanylidene-2-phenylazanyl-ethyl)-1,3-thiazol-2-yl]azanium

Systemtic Name: bis(azanyl)methylidene-[(5S)-4-oxidanylidene-5-(2-oxidanylidene-2-phenylazanyl-ethyl)-1,3-thiazol-2-yl]azanium Openeye Name: [(5S)-5-(2-anilino-2-oxo-ethyl)-4-oxo-thiazol-2-yl]-(diaminomethylene)ammonium CAS Name: [(5S)-5-(2-anilino-2-oxoethyl)-4-oxo-2-thiazolyl]-(diaminomethylidene)ammonium IUPAC Name: [(5S)-5-(2-anilino-2-oxoethyl)-4-oxo-1,3-thiazol-2-yl]-(diaminomethylidene)azanium Traditional Name: [(5S)-5-(2-anilino-2-keto-ethyl)-4-keto-2-thiazolin-2-yl]-(diaminomethylene)ammonium Formula: C12H14N5O2S+ MolecularWeight: 292.33686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CC2C(=O)N=C(S2)[NH+]=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C[C@H]2C(=O)N=C(S2)[NH+]=C(N)N

InChI

InChI=1S/C12H13N5O2S/c13-11(14)17-12-16-10(19)8(20-12)6-9(18)15-7-4-2-1-3-5-7/h1-5,8H,6H2,(H,15,18)(H4,13,14,16,17,19)/p+1/t8-/m0/s1