3-(3,4-dimethylphenyl)-1-ethyl-1-[1-(phenylmethyl)pyrrolidin-3-yl]thiourea

Systemtic Name: 3-(3,4-dimethylphenyl)-1-ethyl-1-[1-(phenylmethyl)pyrrolidin-3-yl]thiourea Openeye Name: 1-(1-benzylpyrrolidin-3-yl)-3-(3,4-dimethylphenyl)-1-ethyl-thiourea CAS Name: 3-(3,4-dimethylphenyl)-1-ethyl-1-[1-(phenylmethyl)-3-pyrrolidinyl]thiourea IUPAC Name: 1-(1-benzylpyrrolidin-3-yl)-3-(3,4-dimethylphenyl)-1-ethylthiourea Traditional Name: 1-(1-benzylpyrrolidin-3-yl)-3-(3,4-dimethylphenyl)-1-ethyl-thiourea Formula: C22H29N3S MolecularWeight: 367.55076

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(C1)CC2=CC=CC=C2)C(=S)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCN(C1CCN(C1)CC2=CC=CC=C2)C(=S)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H29N3S/c1-4-25(22(26)23-20-11-10-17(2)18(3)14-20)21-12-13-24(16-21)15-19-8-6-5-7-9-19/h5-11,14,21H,4,12-13,15-16H2,1-3H3,(H,23,26)