5-[(7-ethylindol-3-ylidene)methyl]-3-(3-methoxyphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: 5-[(7-ethylindol-3-ylidene)methyl]-3-(3-methoxyphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: 5-[(7-ethylindol-3-ylidene)methyl]-3-(3-methoxyphenyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: 5-[(7-ethyl-3-indolylidene)methyl]-3-(3-methoxyphenyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: 5-[(7-ethylindol-3-ylidene)methyl]-3-(3-methoxyphenyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: 5-[(7-ethylindol-3-ylidene)methyl]-6-keto-3-(3-methoxyphenyl)-2-thioxo-pyrimidin-4-olate Formula: C22H18N3O3S- MolecularWeight: 404.46162

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=CC2=CC3=C(N(C(=S)NC3=O)C4=CC(=CC=C4)OC)[O-]

Isomeric SMILES

CCC1=CC=CC2=C1N=CC2=CC3=C(N(C(=S)NC3=O)C4=CC(=CC=C4)OC)[O-]

InChI

InChI=1S/C22H19N3O3S/c1-3-13-6-4-9-17-14(12-23-19(13)17)10-18-20(26)24-22(29)25(21(18)27)15-7-5-8-16(11-15)28-2/h4-12,27H,3H2,1-2H3,(H,24,26,29)/p-1