4-azanyl-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]pyrimidine-5-carbonitrile Formula: C19H13N5OS2 MolecularWeight: 391.46942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)CSC4=NC=C(C(=N4)N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)CSC4=NC=C(C(=N4)N)C#N

InChI

InChI=1S/C19H13N5OS2/c20-9-12-10-22-19(23-18(12)21)26-11-17(25)24-13-5-1-3-7-15(13)27-16-8-4-2-6-14(16)24/h1-8,10H,11H2,(H2,21,22,23)