N-[[5-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide

Systemtic Name: N-[[5-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide Openeye Name: N-[[4-allyl-5-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide CAS Name: N-[[5-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-2-furancarboxamide IUPAC Name: N-[[5-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide Traditional Name: N-[[4-allyl-5-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-1,2,4-triazol-3-yl]methyl]-2-furamide Formula: C25H21N5O3S2 MolecularWeight: 503.59594

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)CNC(=O)C5=CC=CO5

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)CNC(=O)C5=CC=CO5

InChI

InChI=1S/C25H21N5O3S2/c1-2-13-29-22(15-26-24(32)19-10-7-14-33-19)27-28-25(29)34-16-23(31)30-17-8-3-5-11-20(17)35-21-12-6-4-9-18(21)30/h2-12,14H,1,13,15-16H2,(H,26,32)