1-cyclopentyl-3-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]thiourea

Systemtic Name: 1-cyclopentyl-3-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]thiourea Openeye Name: 1-cyclopentyl-3-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]thiourea CAS Name: 1-cyclopentyl-3-[[(E)-1-oxo-3-(1-phenyl-4-pyrazolyl)prop-2-enyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]thiourea Traditional Name: 1-cyclopentyl-3-[[(E)-3-(1-phenylpyrazol-4-yl)acryloyl]amino]thiourea Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)NNC(=O)C=CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(C1)NC(=S)NNC(=O)/C=C/C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H21N5OS/c24-17(21-22-18(25)20-15-6-4-5-7-15)11-10-14-12-19-23(13-14)16-8-2-1-3-9-16/h1-3,8-13,15H,4-7H2,(H,21,24)(H2,20,22,25)/b11-10+