1-(cyclohex-3-en-1-ylmethyl)-1-(3-imidazol-1-ylpropyl)-3-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(3-imidazol-1-ylpropyl)-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(3-imidazol-1-ylpropyl)-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-(1-cyclohex-3-enylmethyl)-1-[3-(1-imidazolyl)propyl]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(3-imidazol-1-ylpropyl)-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(3-imidazol-1-ylpropyl)-3-p-anisyl-thiourea Formula: C22H30N4OS MolecularWeight: 398.5648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)N(CCCN2C=CN=C2)CC3CCC=CC3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)N(CCCN2C=CN=C2)CC3CCC=CC3

InChI

InChI=1S/C22H30N4OS/c1-27-21-10-8-19(9-11-21)16-24-22(28)26(17-20-6-3-2-4-7-20)14-5-13-25-15-12-23-18-25/h2-3,8-12,15,18,20H,4-7,13-14,16-17H2,1H3,(H,24,28)