1-(3-chlorophenyl)-3-[[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]amino]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]amino]thiourea Openeye Name: 1-(3-chlorophenyl)-3-[[(E)-3-(2-ethylbenzofuran-3-yl)prop-2-enoyl]amino]thiourea CAS Name: 1-(3-chlorophenyl)-3-[[(E)-3-(2-ethyl-3-benzofuranyl)-1-oxoprop-2-enyl]amino]thiourea IUPAC Name: 1-(3-chlorophenyl)-3-[[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]amino]thiourea Traditional Name: 1-(3-chlorophenyl)-3-[[(E)-3-(2-ethylbenzofuran-3-yl)acryloyl]amino]thiourea Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C=CC(=O)NNC(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)/C=C/C(=O)NNC(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H18ClN3O2S/c1-2-17-16(15-8-3-4-9-18(15)26-17)10-11-19(25)23-24-20(27)22-14-7-5-6-13(21)12-14/h3-12H,2H2,1H3,(H,23,25)(H2,22,24,27)/b11-10+