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

Systemtic Name: 1-(cyclohexen-1-ylmethyl)-3-(2-methoxy-4-methyl-phenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-(cyclohexen-1-ylmethyl)-3-(2-methoxy-4-methyl-phenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-(1-cyclohexenylmethyl)-3-(2-methoxy-4-methylphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-(cyclohexen-1-ylmethyl)-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(cyclohexen-1-ylmethyl)-3-(2-methoxy-4-methyl-phenyl)-1-(3-pyridylmethyl)thiourea Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N(CC2=CCCCC2)CC3=CN=CC=C3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N(CC2=CCCCC2)CC3=CN=CC=C3)OC

InChI

InChI=1S/C22H27N3OS/c1-17-10-11-20(21(13-17)26-2)24-22(27)25(15-18-7-4-3-5-8-18)16-19-9-6-12-23-14-19/h6-7,9-14H,3-5,8,15-16H2,1-2H3,(H,24,27)