3-(2,5-dimethylphenyl)-1,1-bis(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(2,5-dimethylphenyl)-1,1-bis(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(2,5-dimethylphenyl)-1,1-bis(3-pyridylmethyl)thiourea CAS Name: 3-(2,5-dimethylphenyl)-1,1-bis(3-pyridinylmethyl)thiourea IUPAC Name: 3-(2,5-dimethylphenyl)-1,1-bis(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(2,5-dimethylphenyl)-1,1-bis(3-pyridylmethyl)thiourea Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N(CC2=CN=CC=C2)CC3=CN=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N(CC2=CN=CC=C2)CC3=CN=CC=C3

InChI

InChI=1S/C21H22N4S/c1-16-7-8-17(2)20(11-16)24-21(26)25(14-18-5-3-9-22-12-18)15-19-6-4-10-23-13-19/h3-13H,14-15H2,1-2H3,(H,24,26)