1-(2,3-dimethylphenyl)-3-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[[[4-(1,3-dithiolan-2-yl)phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]thiourea Formula: C19H21N3OS3 MolecularWeight: 403.58454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)C3SCCS3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)C3SCCS3)C

InChI

InChI=1S/C19H21N3OS3/c1-12-4-3-5-16(13(12)2)20-19(24)22-21-17(23)14-6-8-15(9-7-14)18-25-10-11-26-18/h3-9,18H,10-11H2,1-2H3,(H,21,23)(H2,20,22,24)