1-cyclopentyl-3-(phenylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea

Systemtic Name: 1-cyclopentyl-3-(phenylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea Openeye Name: 3-benzyl-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea CAS Name: 1-cyclopentyl-3-(phenylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea IUPAC Name: 3-benzyl-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea Traditional Name: 3-benzyl-1-cyclopentyl-1-(2,3,4-trimethoxybenzyl)thiourea Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN(C2CCCC2)C(=S)NCC3=CC=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN(C2CCCC2)C(=S)NCC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C23H30N2O3S/c1-26-20-14-13-18(21(27-2)22(20)28-3)16-25(19-11-7-8-12-19)23(29)24-15-17-9-5-4-6-10-17/h4-6,9-10,13-14,19H,7-8,11-12,15-16H2,1-3H3,(H,24,29)