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

Systemtic Name: 1-[[(E)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoyl]amino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[[(E)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)prop-2-enoyl]amino]-3-isopentyl-thiourea CAS Name: 1-[[(E)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[[(E)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)prop-2-enoyl]amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[[(E)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)acryloyl]amino]-3-isoamyl-thiourea Formula: C18H26ClN3O3S MolecularWeight: 399.93534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)NNC(=S)NCCC(C)C)Cl)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)NNC(=S)NCCC(C)C)Cl)OC

InChI

InChI=1S/C18H26ClN3O3S/c1-5-25-15-11-13(10-14(19)17(15)24-4)6-7-16(23)21-22-18(26)20-9-8-12(2)3/h6-7,10-12H,5,8-9H2,1-4H3,(H,21,23)(H2,20,22,26)/b7-6+