1-(3-chloranyl-2-methyl-phenyl)-3-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]thiourea Openeye Name: 1-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-3-(3-chloro-2-methyl-phenyl)thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]thiourea IUPAC Name: 1-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-3-(3-chloro-2-methylphenyl)thiourea Traditional Name: 1-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-3-(3-chloro-2-methyl-phenyl)thiourea Formula: C19H23ClN3S+ MolecularWeight: 360.92402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NC2CC[NH+](C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N[C@H]2CC[NH+](C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H22ClN3S/c1-14-17(20)8-5-9-18(14)22-19(24)21-16-10-11-23(13-16)12-15-6-3-2-4-7-15/h2-9,16H,10-13H2,1H3,(H2,21,22,24)/p+1/t16-/m0/s1