1-(2-nitrophenyl)-3-[(phenylmethyl)carbamothioylamino]thiourea

Systemtic Name: 1-(2-nitrophenyl)-3-[(phenylmethyl)carbamothioylamino]thiourea Openeye Name: 1-benzyl-3-[(2-nitrophenyl)carbamothioylamino]thiourea CAS Name: 1-[[(2-nitroanilino)-sulfanylidenemethyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(2-nitrophenyl)carbamothioylamino]thiourea Traditional Name: 1-benzyl-3-[(2-nitrophenyl)thiocarbamoylamino]thiourea Formula: C15H15N5O2S2 MolecularWeight: 361.4419

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15N5O2S2/c21-20(22)13-9-5-4-8-12(13)17-15(24)19-18-14(23)16-10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,16,18,23)(H2,17,19,24)