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

Systemtic Name: 1-(2,5-dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-(2,5-dimethylphenyl)-3-(3-pyridylmethyl)thiourea CAS Name: 1-(2,5-dimethylphenyl)-3-(3-pyridinylmethyl)thiourea IUPAC Name: 1-(2,5-dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(2,5-dimethylphenyl)-3-(3-pyridylmethyl)thiourea Formula: C15H17N3S MolecularWeight: 271.38058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NCC2=CN=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NCC2=CN=CC=C2

InChI

InChI=1S/C15H17N3S/c1-11-5-6-12(2)14(8-11)18-15(19)17-10-13-4-3-7-16-9-13/h3-9H,10H2,1-2H3,(H2,17,18,19)