1-[(3-methyl-2-nitro-phenyl)carbonylamino]-3-(2-methylprop-2-enyl)thiourea

Systemtic Name: 1-[(3-methyl-2-nitro-phenyl)carbonylamino]-3-(2-methylprop-2-enyl)thiourea Openeye Name: 1-(2-methylallyl)-3-[(3-methyl-2-nitro-benzoyl)amino]thiourea CAS Name: 1-[[(3-methyl-2-nitrophenyl)-oxomethyl]amino]-3-(2-methylprop-2-enyl)thiourea IUPAC Name: 1-[(3-methyl-2-nitrobenzoyl)amino]-3-(2-methylprop-2-enyl)thiourea Traditional Name: 1-(2-methylallyl)-3-[(3-methyl-2-nitro-benzoyl)amino]thiourea Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NNC(=S)NCC(=C)C

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NNC(=S)NCC(=C)C

InChI

InChI=1S/C13H16N4O3S/c1-8(2)7-14-13(21)16-15-12(18)10-6-4-5-9(3)11(10)17(19)20/h4-6H,1,7H2,2-3H3,(H,15,18)(H2,14,16,21)