[(Z)-(3-methyl-1-phenyl-5-sulfanylidene-pyrazol-4-ylidene)methyl]-(phenylmethyl)azanium

Systemtic Name: [(Z)-(3-methyl-1-phenyl-5-sulfanylidene-pyrazol-4-ylidene)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(Z)-(3-methyl-1-phenyl-5-thioxo-pyrazol-4-ylidene)methyl]ammonium CAS Name: [(Z)-(3-methyl-1-phenyl-5-sulfanylidene-4-pyrazolylidene)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(Z)-(3-methyl-1-phenyl-5-sulfanylidenepyrazol-4-ylidene)methyl]azanium Traditional Name: benzyl-[(Z)-(3-methyl-1-phenyl-5-thioxo-2-pyrazolin-4-ylidene)methyl]ammonium Formula: C18H18N3S+ MolecularWeight: 308.42062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)C1=C[NH2+]CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=S)/C1=C\[NH2+]CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3S/c1-14-17(13-19-12-15-8-4-2-5-9-15)18(22)21(20-14)16-10-6-3-7-11-16/h2-11,13,19H,12H2,1H3/p+1/b17-13-