4-[(6-oxidanylidene-2,3,4,10b-tetrahydropyrimido[2,1-a]isoindol-1-yl)sulfonyl]benzenecarbonitrile

Systemtic Name: 4-[(6-oxidanylidene-2,3,4,10b-tetrahydropyrimido[2,1-a]isoindol-1-yl)sulfonyl]benzenecarbonitrile Openeye Name: 4-[(6-oxo-2,3,4,10b-tetrahydropyrimido[2,1-a]isoindol-1-yl)sulfonyl]benzonitrile CAS Name: 4-[(6-oxo-2,3,4,10b-tetrahydropyrimido[2,1-a]isoindol-1-yl)sulfonyl]benzonitrile IUPAC Name: 4-[(6-oxo-2,3,4,10b-tetrahydropyrimido[2,1-a]isoindol-1-yl)sulfonyl]benzonitrile Traditional Name: 4-[(6-keto-2,3,4,10b-tetrahydropyrimid[2,1-a]isoindol-1-yl)sulfonyl]benzonitrile Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(C3=CC=CC=C3C2=O)N(C1)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN2C(C3=CC=CC=C3C2=O)N(C1)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C18H15N3O3S/c19-12-13-6-8-14(9-7-13)25(23,24)21-11-3-10-20-17(21)15-4-1-2-5-16(15)18(20)22/h1-2,4-9,17H,3,10-11H2