1-[(2,2-dimethyl-6-oxidanyl-chromen-4-yl)amino]-3-(2,4,6-trimethylphenyl)thiourea

Systemtic Name: 1-[(2,2-dimethyl-6-oxidanyl-chromen-4-yl)amino]-3-(2,4,6-trimethylphenyl)thiourea Openeye Name: 1-[(6-hydroxy-2,2-dimethyl-chromen-4-yl)amino]-3-(2,4,6-trimethylphenyl)thiourea CAS Name: 1-[(6-hydroxy-2,2-dimethyl-1-benzopyran-4-yl)amino]-3-(2,4,6-trimethylphenyl)thiourea IUPAC Name: 1-[(6-hydroxy-2,2-dimethylchromen-4-yl)amino]-3-(2,4,6-trimethylphenyl)thiourea Traditional Name: 1-[(6-hydroxy-2,2-dimethyl-chromen-4-yl)amino]-3-mesityl-thiourea Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=S)NNC2=CC(OC3=C2C=C(C=C3)O)(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=S)NNC2=CC(OC3=C2C=C(C=C3)O)(C)C)C

InChI

InChI=1S/C21H25N3O2S/c1-12-8-13(2)19(14(3)9-12)22-20(27)24-23-17-11-21(4,5)26-18-7-6-15(25)10-16(17)18/h6-11,23,25H,1-5H3,(H2,22,24,27)