1-[2-(2-bromanyl-4-cyano-6-ethoxy-phenoxy)ethanoylamino]-3-(2-methylphenyl)thiourea

Systemtic Name: 1-[2-(2-bromanyl-4-cyano-6-ethoxy-phenoxy)ethanoylamino]-3-(2-methylphenyl)thiourea Openeye Name: 1-[[2-(2-bromo-4-cyano-6-ethoxy-phenoxy)acetyl]amino]-3-(o-tolyl)thiourea CAS Name: 1-[[2-(2-bromo-4-cyano-6-ethoxyphenoxy)-1-oxoethyl]amino]-3-(2-methylphenyl)thiourea IUPAC Name: 1-[[2-(2-bromo-4-cyano-6-ethoxyphenoxy)acetyl]amino]-3-(2-methylphenyl)thiourea Traditional Name: 1-[[2-(2-bromo-4-cyano-6-ethoxy-phenoxy)acetyl]amino]-3-(o-tolyl)thiourea Formula: C19H19BrN4O3S MolecularWeight: 463.34816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OCC(=O)NNC(=S)NC2=CC=CC=C2C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OCC(=O)NNC(=S)NC2=CC=CC=C2C

InChI

InChI=1S/C19H19BrN4O3S/c1-3-26-16-9-13(10-21)8-14(20)18(16)27-11-17(25)23-24-19(28)22-15-7-5-4-6-12(15)2/h4-9H,3,11H2,1-2H3,(H,23,25)(H2,22,24,28)