2,2-dimethyl-4-pyridin-2-ylsulfanyl-1,3-benzoxazine-6-carbonitrile

Systemtic Name: 2,2-dimethyl-4-pyridin-2-ylsulfanyl-1,3-benzoxazine-6-carbonitrile Openeye Name: 2,2-dimethyl-4-(2-pyridylsulfanyl)-1,3-benzoxazine-6-carbonitrile CAS Name: 2,2-dimethyl-4-(2-pyridinylthio)-1,3-benzoxazine-6-carbonitrile IUPAC Name: 2,2-dimethyl-4-pyridin-2-ylsulfanyl-1,3-benzoxazine-6-carbonitrile Traditional Name: 2,2-dimethyl-4-(2-pyridylthio)-1,3-benzoxazine-6-carbonitrile Formula: C16H13N3OS MolecularWeight: 295.35892

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(C2=C(O1)C=CC(=C2)C#N)SC3=CC=CC=N3)C

Isomeric SMILES

CC1(N=C(C2=C(O1)C=CC(=C2)C#N)SC3=CC=CC=N3)C

InChI

InChI=1S/C16H13N3OS/c1-16(2)19-15(21-14-5-3-4-8-18-14)12-9-11(10-17)6-7-13(12)20-16/h3-9H,1-2H3