1-cyclopropyl-3-(2-methoxy-4-methyl-phenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-cyclopropyl-3-(2-methoxy-4-methyl-phenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-cyclopropyl-3-(2-methoxy-4-methyl-phenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-cyclopropyl-3-(2-methoxy-4-methylphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-cyclopropyl-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-cyclopropyl-3-(2-methoxy-4-methyl-phenyl)-1-(3-pyridylmethyl)thiourea Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3OS/c1-13-5-8-16(17(10-13)22-2)20-18(23)21(15-6-7-15)12-14-4-3-9-19-11-14/h3-5,8-11,15H,6-7,12H2,1-2H3,(H,20,23)