1-cyclopropyl-3-(2-ethylphenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-cyclopropyl-3-(2-ethylphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-cyclopropyl-3-(2-ethylphenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-cyclopropyl-3-(2-ethylphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-cyclopropyl-3-(2-ethylphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-cyclopropyl-3-(2-ethylphenyl)-1-(3-pyridylmethyl)thiourea Formula: C18H21N3S MolecularWeight: 311.44444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CC2=CN=CC=C2)C3CC3

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CC2=CN=CC=C2)C3CC3

InChI

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