3-(2,6-diethylphenyl)-1-[(4-methoxyphenyl)methyl]-1-(1-methylpiperidin-4-yl)thiourea

Systemtic Name: 3-(2,6-diethylphenyl)-1-[(4-methoxyphenyl)methyl]-1-(1-methylpiperidin-4-yl)thiourea Openeye Name: 3-(2,6-diethylphenyl)-1-[(4-methoxyphenyl)methyl]-1-(1-methyl-4-piperidyl)thiourea CAS Name: 3-(2,6-diethylphenyl)-1-[(4-methoxyphenyl)methyl]-1-(1-methyl-4-piperidinyl)thiourea IUPAC Name: 3-(2,6-diethylphenyl)-1-[(4-methoxyphenyl)methyl]-1-(1-methylpiperidin-4-yl)thiourea Traditional Name: 3-(2,6-diethylphenyl)-1-(1-methyl-4-piperidyl)-1-p-anisyl-thiourea Formula: C25H35N3OS MolecularWeight: 425.6299

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N(CC2=CC=C(C=C2)OC)C3CCN(CC3)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N(CC2=CC=C(C=C2)OC)C3CCN(CC3)C

InChI

InChI=1S/C25H35N3OS/c1-5-20-8-7-9-21(6-2)24(20)26-25(30)28(22-14-16-27(3)17-15-22)18-19-10-12-23(29-4)13-11-19/h7-13,22H,5-6,14-18H2,1-4H3,(H,26,30)