1-[2-(4-chlorophenyl)ethyl]-3-[(4-nitrophenyl)carbamothioylamino]thiourea

Systemtic Name: 1-[2-(4-chlorophenyl)ethyl]-3-[(4-nitrophenyl)carbamothioylamino]thiourea Openeye Name: 1-[2-(4-chlorophenyl)ethyl]-3-[(4-nitrophenyl)carbamothioylamino]thiourea CAS Name: 1-[2-(4-chlorophenyl)ethyl]-3-[[(4-nitroanilino)-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-[2-(4-chlorophenyl)ethyl]-3-[(4-nitrophenyl)carbamothioylamino]thiourea Traditional Name: 1-[2-(4-chlorophenyl)ethyl]-3-[(4-nitrophenyl)thiocarbamoylamino]thiourea Formula: C16H16ClN5O2S2 MolecularWeight: 409.91354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=S)NNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CCNC(=S)NNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H16ClN5O2S2/c17-12-3-1-11(2-4-12)9-10-18-15(25)20-21-16(26)19-13-5-7-14(8-6-13)22(23)24/h1-8H,9-10H2,(H2,18,20,25)(H2,19,21,26)