5-(indol-3-ylidenemethyl)-6-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: 5-(indol-3-ylidenemethyl)-6-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate Openeye Name: 3-allyl-5-(indol-3-ylidenemethyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: 5-(3-indolylidenemethyl)-6-oxo-3-prop-2-enyl-2-sulfanylidene-4-pyrimidinolate IUPAC Name: 5-(indol-3-ylidenemethyl)-6-oxo-3-prop-2-enyl-2-sulfanylidenepyrimidin-4-olate Traditional Name: 3-allyl-5-(indol-3-ylidenemethyl)-6-keto-2-thioxo-pyrimidin-4-olate Formula: C16H12N3O2S- MolecularWeight: 310.35038

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=C(C(=O)NC1=S)C=C2C=NC3=CC=CC=C32)[O-]

Isomeric SMILES

C=CCN1C(=C(C(=O)NC1=S)C=C2C=NC3=CC=CC=C32)[O-]

InChI

InChI=1S/C16H13N3O2S/c1-2-7-19-15(21)12(14(20)18-16(19)22)8-10-9-17-13-6-4-3-5-11(10)13/h2-6,8-9,21H,1,7H2,(H,18,20,22)/p-1