1-(4-methylphenyl)-3-[2-(3-phenylquinoxalin-2-yl)sulfanylethanoylamino]thiourea

Systemtic Name: 1-(4-methylphenyl)-3-[2-(3-phenylquinoxalin-2-yl)sulfanylethanoylamino]thiourea Openeye Name: 1-[[2-(3-phenylquinoxalin-2-yl)sulfanylacetyl]amino]-3-(p-tolyl)thiourea CAS Name: 1-(4-methylphenyl)-3-[[1-oxo-2-[(3-phenyl-2-quinoxalinyl)thio]ethyl]amino]thiourea IUPAC Name: 1-(4-methylphenyl)-3-[[2-(3-phenylquinoxalin-2-yl)sulfanylacetyl]amino]thiourea Traditional Name: 1-[[2-[(3-phenylquinoxalin-2-yl)thio]acetyl]amino]-3-(p-tolyl)thiourea Formula: C24H21N5OS2 MolecularWeight: 459.58644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NNC(=O)CSC2=NC3=CC=CC=C3N=C2C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NNC(=O)CSC2=NC3=CC=CC=C3N=C2C4=CC=CC=C4

InChI

InChI=1S/C24H21N5OS2/c1-16-11-13-18(14-12-16)25-24(31)29-28-21(30)15-32-23-22(17-7-3-2-4-8-17)26-19-9-5-6-10-20(19)27-23/h2-14H,15H2,1H3,(H,28,30)(H2,25,29,31)