2-ethylsulfanyl-4-methyl-5-oxidanylidene-pyrido[3,2-f][1,4]thiazepine-3-carbonitrile

Systemtic Name: 2-ethylsulfanyl-4-methyl-5-oxidanylidene-pyrido[3,2-f][1,4]thiazepine-3-carbonitrile Openeye Name: 2-ethylsulfanyl-4-methyl-5-oxo-pyrido[3,2-f][1,4]thiazepine-3-carbonitrile CAS Name: 2-(ethylthio)-4-methyl-5-oxo-3-pyrido[3,2-f][1,4]thiazepinecarbonitrile IUPAC Name: 2-ethylsulfanyl-4-methyl-5-oxopyrido[3,2-f][1,4]thiazepine-3-carbonitrile Traditional Name: 2-(ethylthio)-5-keto-4-methyl-pyrido[3,2-f][1,4]thiazepine-3-carbonitrile Formula: C12H11N3OS2 MolecularWeight: 277.36524

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(N(C(=O)C2=C(S1)N=CC=C2)C)C#N

Isomeric SMILES

CCSC1=C(N(C(=O)C2=C(S1)N=CC=C2)C)C#N

InChI

InChI=1S/C12H11N3OS2/c1-3-17-12-9(7-13)15(2)11(16)8-5-4-6-14-10(8)18-12/h4-6H,3H2,1-2H3