1-[(2,4-dinitrophenyl)amino]-3-(2-methylprop-2-enyl)thiourea

Systemtic Name: 1-[(2,4-dinitrophenyl)amino]-3-(2-methylprop-2-enyl)thiourea Openeye Name: 1-(2,4-dinitroanilino)-3-(2-methylallyl)thiourea CAS Name: 1-(2,4-dinitroanilino)-3-(2-methylprop-2-enyl)thiourea IUPAC Name: 1-(2,4-dinitroanilino)-3-(2-methylprop-2-enyl)thiourea Traditional Name: 1-(2,4-dinitroanilino)-3-(2-methylallyl)thiourea Formula: C11H13N5O4S MolecularWeight: 311.31702

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CNC(=S)NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=C)CNC(=S)NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H13N5O4S/c1-7(2)6-12-11(21)14-13-9-4-3-8(15(17)18)5-10(9)16(19)20/h3-5,13H,1,6H2,2H3,(H2,12,14,21)