1-[(E)-(3-chloranyl-5-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-(3-chloranyl-5-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-(3-chloro-5-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]thiourea CAS Name: 1-[(E)-(3-chloro-5-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-(3-chloro-5-methyl-1-phenylpyrazol-4-yl)methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-(3-chloro-5-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]thiourea Formula: C15H16ClN5S MolecularWeight: 333.83904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)Cl)C=NNC(=S)NCC=C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)Cl)/C=N/NC(=S)NCC=C

InChI

InChI=1S/C15H16ClN5S/c1-3-9-17-15(22)19-18-10-13-11(2)21(20-14(13)16)12-7-5-4-6-8-12/h3-8,10H,1,9H2,2H3,(H2,17,19,22)/b18-10+