1-(4-butylphenyl)-3-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[2-(2-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[2-(2-methoxyphenyl)-2-pyrrolidino-ethyl]thiourea Formula: C24H33N3OS MolecularWeight: 411.60332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC(C2=CC=CC=C2OC)N3CCCC3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC(C2=CC=CC=C2OC)N3CCCC3

InChI

InChI=1S/C24H33N3OS/c1-3-4-9-19-12-14-20(15-13-19)26-24(29)25-18-22(27-16-7-8-17-27)21-10-5-6-11-23(21)28-2/h5-6,10-15,22H,3-4,7-9,16-18H2,1-2H3,(H2,25,26,29)