1-[[(E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]prop-2-enoyl]amino]-3-cyclopentyl-thiourea

Systemtic Name: 1-[[(E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]prop-2-enoyl]amino]-3-cyclopentyl-thiourea Openeye Name: 1-[[(E)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)prop-2-enoyl]amino]-3-cyclopentyl-thiourea CAS Name: 1-[[(E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-1-oxoprop-2-enyl]amino]-3-cyclopentylthiourea IUPAC Name: 1-[[(E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]prop-2-enoyl]amino]-3-cyclopentylthiourea Traditional Name: 1-[[(E)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)acryloyl]amino]-3-cyclopentyl-thiourea Formula: C17H26ClN5OS MolecularWeight: 383.93924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)NNC(=S)NC2CCCC2)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)NNC(=S)NC2CCCC2)Cl)CC(C)C

InChI

InChI=1S/C17H26ClN5OS/c1-11(2)10-23-16(18)14(12(3)22-23)8-9-15(24)20-21-17(25)19-13-6-4-5-7-13/h8-9,11,13H,4-7,10H2,1-3H3,(H,20,24)(H2,19,21,25)/b9-8+