1-[[(E)-3-[3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoyl]amino]-3-cyclohexyl-thiourea

Systemtic Name: 1-[[(E)-3-[3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoyl]amino]-3-cyclohexyl-thiourea Openeye Name: 1-[[(E)-3-(3-chloro-4-isobutoxy-5-methoxy-phenyl)prop-2-enoyl]amino]-3-cyclohexyl-thiourea CAS Name: 1-[[(E)-3-[3-chloro-5-methoxy-4-(2-methylpropoxy)phenyl]-1-oxoprop-2-enyl]amino]-3-cyclohexylthiourea IUPAC Name: 1-[[(E)-3-[3-chloro-5-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoyl]amino]-3-cyclohexylthiourea Traditional Name: 1-[[(E)-3-(3-chloro-4-isobutoxy-5-methoxy-phenyl)acryloyl]amino]-3-cyclohexyl-thiourea Formula: C21H30ClN3O3S MolecularWeight: 439.9992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1Cl)C=CC(=O)NNC(=S)NC2CCCCC2)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1Cl)/C=C/C(=O)NNC(=S)NC2CCCCC2)OC

InChI

InChI=1S/C21H30ClN3O3S/c1-14(2)13-28-20-17(22)11-15(12-18(20)27-3)9-10-19(26)24-25-21(29)23-16-7-5-4-6-8-16/h9-12,14,16H,4-8,13H2,1-3H3,(H,24,26)(H2,23,25,29)/b10-9+