1-[[6-cyano-2,2-dimethyl-4-(2-oxidanylidenepyridin-1-yl)chromen-3-yl]methyl]-3-ethyl-1-methyl-thiourea

Systemtic Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxidanylidenepyridin-1-yl)chromen-3-yl]methyl]-3-ethyl-1-methyl-thiourea Openeye Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxo-1-pyridyl)chromen-3-yl]methyl]-3-ethyl-1-methyl-thiourea CAS Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxo-1-pyridinyl)-1-benzopyran-3-yl]methyl]-3-ethyl-1-methylthiourea IUPAC Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxopyridin-1-yl)chromen-3-yl]methyl]-3-ethyl-1-methylthiourea Traditional Name: 1-[[6-cyano-4-(2-keto-1-pyridyl)-2,2-dimethyl-chromen-3-yl]methyl]-3-ethyl-1-methyl-thiourea Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N(C)CC1=C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3C=CC=CC3=O

Isomeric SMILES

CCNC(=S)N(C)CC1=C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3C=CC=CC3=O

InChI

InChI=1S/C22H24N4O2S/c1-5-24-21(29)25(4)14-17-20(26-11-7-6-8-19(26)27)16-12-15(13-23)9-10-18(16)28-22(17,2)3/h6-12H,5,14H2,1-4H3,(H,24,29)