1-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]-3-(2,3-dimethylphenyl)thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NNC(=O)C=CC2=CC(=CC=C2)Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NNC(=O)/C=C/C2=CC(=CC=C2)Br)C

InChI

InChI=1S/C18H18BrN3OS/c1-12-5-3-8-16(13(12)2)20-18(24)22-21-17(23)10-9-14-6-4-7-15(19)11-14/h3-11H,1-2H3,(H,21,23)(H2,20,22,24)/b10-9+