1-(2-chloranyl-5-nitro-phenyl)-3-(prop-2-enylcarbamothioylamino)thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-(prop-2-enylcarbamothioylamino)thiourea Openeye Name: 1-allyl-3-[(2-chloro-5-nitro-phenyl)carbamothioylamino]thiourea CAS Name: 1-[[(2-chloro-5-nitroanilino)-sulfanylidenemethyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-(prop-2-enylcarbamothioylamino)thiourea Traditional Name: 1-allyl-3-[(2-chloro-5-nitro-phenyl)thiocarbamoylamino]thiourea Formula: C11H12ClN5O2S2 MolecularWeight: 345.82828

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

C=CCNC(=S)NNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H12ClN5O2S2/c1-2-5-13-10(20)15-16-11(21)14-9-6-7(17(18)19)3-4-8(9)12/h2-4,6H,1,5H2,(H2,13,15,20)(H2,14,16,21)