1-(3-chlorophenyl)-3-[[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]amino]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]amino]thiourea Openeye Name: 1-(3-chlorophenyl)-3-[[(E)-3-(5-nitro-2-furyl)prop-2-enoyl]amino]thiourea CAS Name: 1-(3-chlorophenyl)-3-[[(E)-3-(5-nitro-2-furanyl)-1-oxoprop-2-enyl]amino]thiourea IUPAC Name: 1-(3-chlorophenyl)-3-[[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]amino]thiourea Traditional Name: 1-(3-chlorophenyl)-3-[[(E)-3-(5-nitro-2-furyl)acryloyl]amino]thiourea Formula: C14H11ClN4O4S MolecularWeight: 366.77954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC(=S)NNC(=O)C=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC(=S)NNC(=O)/C=C/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C14H11ClN4O4S/c15-9-2-1-3-10(8-9)16-14(24)18-17-12(20)6-4-11-5-7-13(23-11)19(21)22/h1-8H,(H,17,20)(H2,16,18,24)/b6-4+