1-[(E)-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[(E)-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[(E)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[(E)-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]methylideneamino]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[(E)-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)methylideneamino]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[(E)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-(tetrahydrofurfuryl)thiourea Formula: C18H22ClN5OS MolecularWeight: 391.91818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=S)NCC2CCCO2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=S)NCC2CCCO2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C18H22ClN5OS/c1-13-16(11-21-22-18(26)20-10-15-8-5-9-25-15)17(19)24(23-13)12-14-6-3-2-4-7-14/h2-4,6-7,11,15H,5,8-10,12H2,1H3,(H2,20,22,26)/b21-11+