3-butyl-1-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-1-methyl-thiourea

Systemtic Name: 3-butyl-1-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-1-methyl-thiourea Openeye Name: 3-butyl-1-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-1-methyl-thiourea CAS Name: 3-butyl-1-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-1-methylthiourea IUPAC Name: 3-butyl-1-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methylideneamino]-1-methylthiourea Traditional Name: 3-butyl-1-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-1-methyl-thiourea Formula: C24H29N5O2S MolecularWeight: 451.58436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(C)N=CC1=CN(N=C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=S)N(C)/N=C/C1=CN(N=C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H29N5O2S/c1-5-6-14-25-24(32)28(2)26-16-19-17-29(20-10-8-7-9-11-20)27-23(19)18-12-13-21(30-3)22(15-18)31-4/h7-13,15-17H,5-6,14H2,1-4H3,(H,25,32)/b26-16+