1-[(E)-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]methylideneamino]-3-methyl-thiourea

Systemtic Name: 1-[(E)-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]methylideneamino]-3-methyl-thiourea Openeye Name: 1-[(E)-[3,5-dimethyl-1-(p-tolylmethyl)pyrazol-4-yl]methyleneamino]-3-methyl-thiourea CAS Name: 1-[(E)-[3,5-dimethyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]methylideneamino]-3-methylthiourea IUPAC Name: 1-[(E)-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]methylideneamino]-3-methylthiourea Traditional Name: 1-[(E)-[3,5-dimethyl-1-(4-methylbenzyl)pyrazol-4-yl]methyleneamino]-3-methyl-thiourea Formula: C16H21N5S MolecularWeight: 315.43644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C=NNC(=S)NC)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)/C=N/NC(=S)NC)C

InChI

InChI=1S/C16H21N5S/c1-11-5-7-14(8-6-11)10-21-13(3)15(12(2)20-21)9-18-19-16(22)17-4/h5-9H,10H2,1-4H3,(H2,17,19,22)/b18-9+