1-[methyl-[(phenylmethyl)carbamothioyl]amino]-3-(3-nitrophenyl)urea

Systemtic Name: 1-[methyl-[(phenylmethyl)carbamothioyl]amino]-3-(3-nitrophenyl)urea Openeye Name: 1-[benzylcarbamothioyl(methyl)amino]-3-(3-nitrophenyl)urea CAS Name: 1-[methyl-[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]-3-(3-nitrophenyl)urea IUPAC Name: 1-[benzylcarbamothioyl(methyl)amino]-3-(3-nitrophenyl)urea Traditional Name: 1-[benzylthiocarbamoyl(methyl)amino]-3-(3-nitrophenyl)urea Formula: C16H17N5O3S MolecularWeight: 359.40288

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCC1=CC=CC=C1)NC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C(=S)NCC1=CC=CC=C1)NC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N5O3S/c1-20(16(25)17-11-12-6-3-2-4-7-12)19-15(22)18-13-8-5-9-14(10-13)21(23)24/h2-10H,11H2,1H3,(H,17,25)(H2,18,19,22)