1-[2-(4-chlorophenyl)sulfanylethyl]-3-[(3-nitrophenyl)carbonylamino]thiourea

Systemtic Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-[(3-nitrophenyl)carbonylamino]thiourea Openeye Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-[(3-nitrobenzoyl)amino]thiourea CAS Name: 1-[2-[(4-chlorophenyl)thio]ethyl]-3-[[(3-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-[(3-nitrobenzoyl)amino]thiourea Traditional Name: 1-[2-[(4-chlorophenyl)thio]ethyl]-3-[(3-nitrobenzoyl)amino]thiourea Formula: C16H15ClN4O3S2 MolecularWeight: 410.8983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NNC(=S)NCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NNC(=S)NCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H15ClN4O3S2/c17-12-4-6-14(7-5-12)26-9-8-18-16(25)20-19-15(22)11-2-1-3-13(10-11)21(23)24/h1-7,10H,8-9H2,(H,19,22)(H2,18,20,25)