3-(2-chloranyl-4-methyl-phenyl)-1-ethyl-1-[1-(phenylmethyl)pyrrolidin-3-yl]thiourea

Systemtic Name: 3-(2-chloranyl-4-methyl-phenyl)-1-ethyl-1-[1-(phenylmethyl)pyrrolidin-3-yl]thiourea Openeye Name: 1-(1-benzylpyrrolidin-3-yl)-3-(2-chloro-4-methyl-phenyl)-1-ethyl-thiourea CAS Name: 3-(2-chloro-4-methylphenyl)-1-ethyl-1-[1-(phenylmethyl)-3-pyrrolidinyl]thiourea IUPAC Name: 1-(1-benzylpyrrolidin-3-yl)-3-(2-chloro-4-methylphenyl)-1-ethylthiourea Traditional Name: 1-(1-benzylpyrrolidin-3-yl)-3-(2-chloro-4-methyl-phenyl)-1-ethyl-thiourea Formula: C21H26ClN3S MolecularWeight: 387.96924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3S/c1-3-25(21(26)23-20-10-9-16(2)13-19(20)22)18-11-12-24(15-18)14-17-7-5-4-6-8-17/h4-10,13,18H,3,11-12,14-15H2,1-2H3,(H,23,26)