4-[1H-imidazol-2-ylmethyl-(4-phenyl-1,3-thiazol-2-yl)amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 4-[1H-imidazol-2-ylmethyl-(4-phenyl-1,3-thiazol-2-yl)amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-4-[1H-imidazol-2-ylmethyl-(4-phenylthiazol-2-yl)amino]-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 3-hydroxy-4-[1H-imidazol-2-ylmethyl-(4-phenyl-2-thiazolyl)amino]-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-4-[1H-imidazol-2-ylmethyl-(4-phenyl-1,3-thiazol-2-yl)amino]-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-4-[1H-imidazol-2-ylmethyl-(4-phenylthiazol-2-yl)amino]-2,2-dimethyl-chroman-6-carbonitrile Formula: C25H23N5O2S MolecularWeight: 457.54742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CC3=NC=CN3)C4=NC(=CS4)C5=CC=CC=C5)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CC3=NC=CN3)C4=NC(=CS4)C5=CC=CC=C5)O)C

InChI

InChI=1S/C25H23N5O2S/c1-25(2)23(31)22(18-12-16(13-26)8-9-20(18)32-25)30(14-21-27-10-11-28-21)24-29-19(15-33-24)17-6-4-3-5-7-17/h3-12,15,22-23,31H,14H2,1-2H3,(H,27,28)