1-methyl-5-(2-sulfanylidenespiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)pyrrole-2-carbonitrile

Systemtic Name: 1-methyl-5-(2-sulfanylidenespiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)pyrrole-2-carbonitrile Openeye Name: 1-methyl-5-(2-thioxospiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)pyrrole-2-carbonitrile CAS Name: 1-methyl-5-(2-sulfanylidene-6-spiro[1H-3,1-benzoxazine-4,1'-cyclohexane]yl)-2-pyrrolecarbonitrile IUPAC Name: 1-methyl-5-(2-sulfanylidenespiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)pyrrole-2-carbonitrile Traditional Name: 1-methyl-5-(2-thioxospiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)pyrrole-2-carbonitrile Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C2=CC3=C(C=C2)NC(=S)OC34CCCCC4)C#N

Isomeric SMILES

CN1C(=CC=C1C2=CC3=C(C=C2)NC(=S)OC34CCCCC4)C#N

InChI

InChI=1S/C19H19N3OS/c1-22-14(12-20)6-8-17(22)13-5-7-16-15(11-13)19(23-18(24)21-16)9-3-2-4-10-19/h5-8,11H,2-4,9-10H2,1H3,(H,21,24)