1-methyl-1-[(Z)-(5-nitrofuran-2-yl)methylideneamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-methyl-1-[(Z)-(5-nitrofuran-2-yl)methylideneamino]-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-methyl-1-[(Z)-(5-nitro-2-furyl)methyleneamino]thiourea CAS Name: 1-methyl-1-[(Z)-(5-nitro-2-furanyl)methylideneamino]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-methyl-1-[(Z)-(5-nitrofuran-2-yl)methylideneamino]thiourea Traditional Name: 3-benzyl-1-methyl-1-[(Z)-(5-nitro-2-furyl)methyleneamino]thiourea Formula: C14H14N4O3S MolecularWeight: 318.35096

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCC1=CC=CC=C1)N=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CN(C(=S)NCC1=CC=CC=C1)/N=C\C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O3S/c1-17(14(22)15-9-11-5-3-2-4-6-11)16-10-12-7-8-13(21-12)18(19)20/h2-8,10H,9H2,1H3,(H,15,22)/b16-10-