1-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]-1-methyl-3-(phenylmethyl)thiourea

Systemtic Name: 1-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]-1-methyl-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]-1-methyl-thiourea CAS Name: 1-[[(E)-3-(3-bromophenyl)-1-oxoprop-2-enyl]amino]-1-methyl-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]-1-methylthiourea Traditional Name: 3-benzyl-1-[[(E)-3-(3-bromophenyl)acryloyl]amino]-1-methyl-thiourea Formula: C18H18BrN3OS MolecularWeight: 404.32402

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCC1=CC=CC=C1)NC(=O)C=CC2=CC(=CC=C2)Br

Isomeric SMILES

CN(C(=S)NCC1=CC=CC=C1)NC(=O)/C=C/C2=CC(=CC=C2)Br

InChI

InChI=1S/C18H18BrN3OS/c1-22(18(24)20-13-15-6-3-2-4-7-15)21-17(23)11-10-14-8-5-9-16(19)12-14/h2-12H,13H2,1H3,(H,20,24)(H,21,23)/b11-10+