[(Z)-[(5S)-3-methyl-5-phenyl-2-sulfanylidene-1,3,4-thiadiazinan-6-ylidene]amino] 4-chloranylbenzoate

Systemtic Name: [(Z)-[(5S)-3-methyl-5-phenyl-2-sulfanylidene-1,3,4-thiadiazinan-6-ylidene]amino] 4-chloranylbenzoate Openeye Name: [(Z)-[(5S)-3-methyl-5-phenyl-2-thioxo-1,3,4-thiadiazinan-6-ylidene]amino] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(Z)-[(5S)-3-methyl-5-phenyl-2-sulfanylidene-1,3,4-thiadiazinan-6-ylidene]amino] ester IUPAC Name: [(Z)-[(5S)-3-methyl-5-phenyl-2-sulfanylidene-1,3,4-thiadiazinan-6-ylidene]amino] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(Z)-[(5S)-3-methyl-5-phenyl-2-thioxo-1,3,4-thiadiazinan-6-ylidene]amino] ester Formula: C17H14ClN3O2S2 MolecularWeight: 391.89496

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)SC(=NOC(=O)C2=CC=C(C=C2)Cl)C(N1)C3=CC=CC=C3

Isomeric SMILES

CN1C(=S)S/C(=N\OC(=O)C2=CC=C(C=C2)Cl)/[C@@H](N1)C3=CC=CC=C3

InChI

InChI=1S/C17H14ClN3O2S2/c1-21-17(24)25-15(14(19-21)11-5-3-2-4-6-11)20-23-16(22)12-7-9-13(18)10-8-12/h2-10,14,19H,1H3/b20-15-/t14-/m0/s1