3-(3-fluoranyl-4-methyl-phenyl)-1-methyl-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea

Systemtic Name: 3-(3-fluoranyl-4-methyl-phenyl)-1-methyl-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea Openeye Name: 3-(3-fluoro-4-methyl-phenyl)-1-methyl-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea CAS Name: 3-(3-fluoro-4-methylphenyl)-1-methyl-1-[[2-(1-pyrrolidinyl)phenyl]methyl]thiourea IUPAC Name: 3-(3-fluoro-4-methylphenyl)-1-methyl-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea Traditional Name: 3-(3-fluoro-4-methyl-phenyl)-1-methyl-1-(2-pyrrolidinobenzyl)thiourea Formula: C20H24FN3S MolecularWeight: 357.488063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=CC=CC=C2N3CCCC3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=CC=CC=C2N3CCCC3)F

InChI

InChI=1S/C20H24FN3S/c1-15-9-10-17(13-18(15)21)22-20(25)23(2)14-16-7-3-4-8-19(16)24-11-5-6-12-24/h3-4,7-10,13H,5-6,11-12,14H2,1-2H3,(H,22,25)