1-(2-ethyl-6-methyl-phenyl)-3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[(E)-3-(3-nitrophenyl)acryloyl]amino]thiourea Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C19H20N4O3S/c1-3-15-8-4-6-13(2)18(15)20-19(27)22-21-17(24)11-10-14-7-5-9-16(12-14)23(25)26/h4-12H,3H2,1-2H3,(H,21,24)(H2,20,22,27)/b11-10+