N-[cyclopropylmethyl-(phenylmethyl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[cyclopropylmethyl-(phenylmethyl)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-nitro-benzamide CAS Name: N-[[cyclopropylmethyl-(phenylmethyl)amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-nitrobenzamide Traditional Name: N-[benzyl(cyclopropylmethyl)thiocarbamoyl]-3-nitro-benzamide Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CC2=CC=CC=C2)C(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC1CN(CC2=CC=CC=C2)C(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O3S/c23-18(16-7-4-8-17(11-16)22(24)25)20-19(26)21(13-15-9-10-15)12-14-5-2-1-3-6-14/h1-8,11,15H,9-10,12-13H2,(H,20,23,26)