1-(3-chloranyl-9H-pyrido[2,3-b]indol-6-yl)-2-(2-phenoxyethylsulfanyl)ethanone

Systemtic Name: 1-(3-chloranyl-9H-pyrido[2,3-b]indol-6-yl)-2-(2-phenoxyethylsulfanyl)ethanone Openeye Name: 1-(3-chloro-9H-pyrido[2,3-b]indol-6-yl)-2-(2-phenoxyethylsulfanyl)ethanone CAS Name: 1-(3-chloro-9H-pyrido[2,3-b]indol-6-yl)-2-(2-phenoxyethylthio)ethanone IUPAC Name: 1-(3-chloro-9H-pyrido[2,3-b]indol-6-yl)-2-(2-phenoxyethylsulfanyl)ethanone Traditional Name: 1-(3-chloro-9H-pyrid[2,3-b]indol-6-yl)-2-(2-phenoxyethylthio)ethanone Formula: C21H17ClN2O2S MolecularWeight: 396.88988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCSCC(=O)C2=CC3=C(C=C2)NC4=NC=C(C=C34)Cl

Isomeric SMILES

C1=CC=C(C=C1)OCCSCC(=O)C2=CC3=C(C=C2)NC4=NC=C(C=C34)Cl

InChI

InChI=1S/C21H17ClN2O2S/c22-15-11-18-17-10-14(6-7-19(17)24-21(18)23-12-15)20(25)13-27-9-8-26-16-4-2-1-3-5-16/h1-7,10-12H,8-9,13H2,(H,23,24)