1-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 1-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-allyl-1-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 1-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 1-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-allyl-1-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C26H19N5O2S2 MolecularWeight: 497.59136

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C26H19N5O2S2/c1-2-15-29-24(33)17-9-3-4-10-18(17)31-25(29)27-28-26(31)34-16-23(32)30-19-11-5-7-13-21(19)35-22-14-8-6-12-20(22)30/h2-14H,1,15-16H2