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

Systemtic Name: 1-[[2,2-dimethyl-6-[(2-methylphenyl)methoxy]chromen-4-yl]amino]-3-(3-methylphenyl)thiourea Openeye Name: 1-[[2,2-dimethyl-6-(o-tolylmethoxy)chromen-4-yl]amino]-3-(m-tolyl)thiourea CAS Name: 1-[[2,2-dimethyl-6-[(2-methylphenyl)methoxy]-1-benzopyran-4-yl]amino]-3-(3-methylphenyl)thiourea IUPAC Name: 1-[[2,2-dimethyl-6-[(2-methylphenyl)methoxy]chromen-4-yl]amino]-3-(3-methylphenyl)thiourea Traditional Name: 1-[[2,2-dimethyl-6-(2-methylbenzyl)oxy-chromen-4-yl]amino]-3-(m-tolyl)thiourea Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NNC2=CC(OC3=C2C=C(C=C3)OCC4=CC=CC=C4C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NNC2=CC(OC3=C2C=C(C=C3)OCC4=CC=CC=C4C)(C)C

InChI

InChI=1S/C27H29N3O2S/c1-18-8-7-11-21(14-18)28-26(33)30-29-24-16-27(3,4)32-25-13-12-22(15-23(24)25)31-17-20-10-6-5-9-19(20)2/h5-16,29H,17H2,1-4H3,(H2,28,30,33)