1-cyclopropyl-3-(2,5-dimethylphenyl)-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-cyclopropyl-3-(2,5-dimethylphenyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-cyclopropyl-3-(2,5-dimethylphenyl)-1-(4-pyridylmethyl)thiourea CAS Name: 1-cyclopropyl-3-(2,5-dimethylphenyl)-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-cyclopropyl-3-(2,5-dimethylphenyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-cyclopropyl-3-(2,5-dimethylphenyl)-1-(4-pyridylmethyl)thiourea Formula: C18H21N3S MolecularWeight: 311.44444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N(CC2=CC=NC=C2)C3CC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N(CC2=CC=NC=C2)C3CC3

InChI

InChI=1S/C18H21N3S/c1-13-3-4-14(2)17(11-13)20-18(22)21(16-5-6-16)12-15-7-9-19-10-8-15/h3-4,7-11,16H,5-6,12H2,1-2H3,(H,20,22)