N-[3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide

Systemtic Name: N-[3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Openeye Name: N-[3-(2-anilino-2-oxo-ethyl)sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide CAS Name: N-[3-[(2-anilino-2-oxoethyl)thio]phenyl]-4a,10a-dihydrophenothiazine-10-carboxamide IUPAC Name: N-[3-(2-anilino-2-oxoethyl)sulfanylphenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Traditional Name: N-[3-[(2-anilino-2-keto-ethyl)thio]phenyl]-4a,10a-dihydrophenothiazine-10-carboxamide Formula: C27H23N3O2S2 MolecularWeight: 485.62042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)N3C4C=CC=CC4SC5=CC=CC=C53

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)N3C4C=CC=CC4SC5=CC=CC=C53

InChI

InChI=1S/C27H23N3O2S2/c31-26(28-19-9-2-1-3-10-19)18-33-21-12-8-11-20(17-21)29-27(32)30-22-13-4-6-15-24(22)34-25-16-7-5-14-23(25)30/h1-17,22,24H,18H2,(H,28,31)(H,29,32)