1-(3-chloranyl-4-methyl-phenyl)-3-[(2-nitrophenyl)carbamothioylamino]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[(2-nitrophenyl)carbamothioylamino]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[(2-nitrophenyl)carbamothioylamino]thiourea CAS Name: 1-[[(3-chloro-4-methylanilino)-sulfanylidenemethyl]amino]-3-(2-nitrophenyl)thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[(2-nitrophenyl)carbamothioylamino]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[(2-nitrophenyl)thiocarbamoylamino]thiourea Formula: C15H14ClN5O2S2 MolecularWeight: 395.88696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=S)NC2=CC=CC=C2[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=S)NC2=CC=CC=C2[N+](=O)[O-])Cl

InChI

InChI=1S/C15H14ClN5O2S2/c1-9-6-7-10(8-11(9)16)17-14(24)19-20-15(25)18-12-4-2-3-5-13(12)21(22)23/h2-8H,1H3,(H2,17,19,24)(H2,18,20,25)