1-[[(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]amino]-3-(2-methylphenyl)thiourea

Systemtic Name: 1-[[(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]amino]-3-(2-methylphenyl)thiourea Openeye Name: 1-[[(E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)prop-2-enoyl]amino]-3-(o-tolyl)thiourea CAS Name: 1-[[(E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-1-oxoprop-2-enyl]amino]-3-(2-methylphenyl)thiourea IUPAC Name: 1-[[(E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)prop-2-enoyl]amino]-3-(2-methylphenyl)thiourea Traditional Name: 1-[[(E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)acryloyl]amino]-3-(o-tolyl)thiourea Formula: C21H24ClN3O3S MolecularWeight: 433.95156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NNC(=O)C=CC2=CC(=C(C(=C2)Cl)OC(C)C)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NNC(=O)/C=C/C2=CC(=C(C(=C2)Cl)OC(C)C)OC

InChI

InChI=1S/C21H24ClN3O3S/c1-13(2)28-20-16(22)11-15(12-18(20)27-4)9-10-19(26)24-25-21(29)23-17-8-6-5-7-14(17)3/h5-13H,1-4H3,(H,24,26)(H2,23,25,29)/b10-9+