1-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]-3-(3-methoxypropyl)-1-methyl-thiourea

Systemtic Name: 1-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]-3-(3-methoxypropyl)-1-methyl-thiourea Openeye Name: 1-[[(E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoyl]amino]-3-(3-methoxypropyl)-1-methyl-thiourea CAS Name: 1-[[(E)-3-(5-bromo-2-methoxyphenyl)-1-oxoprop-2-enyl]amino]-3-(3-methoxypropyl)-1-methylthiourea IUPAC Name: 1-[[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino]-3-(3-methoxypropyl)-1-methylthiourea Traditional Name: 1-[[(E)-3-(5-bromo-2-methoxy-phenyl)acryloyl]amino]-3-(3-methoxypropyl)-1-methyl-thiourea Formula: C16H22BrN3O3S MolecularWeight: 416.33318

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCCCOC)NC(=O)C=CC1=C(C=CC(=C1)Br)OC

Isomeric SMILES

CN(C(=S)NCCCOC)NC(=O)/C=C/C1=C(C=CC(=C1)Br)OC

InChI

InChI=1S/C16H22BrN3O3S/c1-20(16(24)18-9-4-10-22-2)19-15(21)8-5-12-11-13(17)6-7-14(12)23-3/h5-8,11H,4,9-10H2,1-3H3,(H,18,24)(H,19,21)/b8-5+