1-cyclopentyl-3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiourea

Systemtic Name: 1-cyclopentyl-3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiourea Openeye Name: 1-cyclopentyl-3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiourea CAS Name: 1-cyclopentyl-3-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiourea Traditional Name: 1-cyclopentyl-3-[[(E)-3-(3-nitrophenyl)acryloyl]amino]thiourea Formula: C15H18N4O3S MolecularWeight: 334.39342

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)NNC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)NC(=S)NNC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O3S/c20-14(17-18-15(23)16-12-5-1-2-6-12)9-8-11-4-3-7-13(10-11)19(21)22/h3-4,7-10,12H,1-2,5-6H2,(H,17,20)(H2,16,18,23)/b9-8+