1-(4-chlorophenyl)-3-[[(3S)-1-(4-ethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-[[(3S)-1-(4-ethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[[(3S)-1-(4-ethylphenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]thiourea CAS Name: 1-(4-chlorophenyl)-3-[[[(3S)-1-(4-ethylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[[(3S)-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[[(3S)-1-(4-ethylphenyl)-5-keto-pyrrolidine-3-carbonyl]amino]thiourea Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NNC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NNC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN4O2S/c1-2-13-3-9-17(10-4-13)25-12-14(11-18(25)26)19(27)23-24-20(28)22-16-7-5-15(21)6-8-16/h3-10,14H,2,11-12H2,1H3,(H,23,27)(H2,22,24,28)/t14-/m0/s1