3-butyl-1-cyclopentyl-1-[(2-methoxyphenyl)methyl]thiourea

Systemtic Name: 3-butyl-1-cyclopentyl-1-[(2-methoxyphenyl)methyl]thiourea Openeye Name: 3-butyl-1-cyclopentyl-1-[(2-methoxyphenyl)methyl]thiourea CAS Name: 3-butyl-1-cyclopentyl-1-[(2-methoxyphenyl)methyl]thiourea IUPAC Name: 3-butyl-1-cyclopentyl-1-[(2-methoxyphenyl)methyl]thiourea Traditional Name: 3-butyl-1-cyclopentyl-1-o-anisyl-thiourea Formula: C18H28N2OS MolecularWeight: 320.49272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CC1=CC=CC=C1OC)C2CCCC2

Isomeric SMILES

CCCCNC(=S)N(CC1=CC=CC=C1OC)C2CCCC2

InChI

InChI=1S/C18H28N2OS/c1-3-4-13-19-18(22)20(16-10-6-7-11-16)14-15-9-5-8-12-17(15)21-2/h5,8-9,12,16H,3-4,6-7,10-11,13-14H2,1-2H3,(H,19,22)