1-[(3S,4R)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-3-pyridin-2-yl-urea

Systemtic Name: 1-[(3S,4R)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-3-pyridin-2-yl-urea Openeye Name: 1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]-3-(2-pyridyl)urea CAS Name: 1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-3-(2-pyridinyl)urea IUPAC Name: 1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-3-pyridin-2-ylurea Traditional Name: 1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]-3-(2-pyridyl)urea Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=O)NC3=CC=CC=N3)O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(O1)C=CC(=C2)C#N)NC(=O)NC3=CC=CC=N3)O)C

InChI

InChI=1S/C18H18N4O3/c1-18(2)16(23)15(12-9-11(10-19)6-7-13(12)25-18)22-17(24)21-14-5-3-4-8-20-14/h3-9,15-16,23H,1-2H3,(H2,20,21,22,24)/t15-,16+/m1/s1