1-phenyl-3-[3-(phenylsulfonylamino)propanoylamino]thiourea

Systemtic Name: 1-phenyl-3-[3-(phenylsulfonylamino)propanoylamino]thiourea Openeye Name: 1-[3-(benzenesulfonamido)propanoylamino]-3-phenyl-thiourea CAS Name: 1-[[3-(benzenesulfonamido)-1-oxopropyl]amino]-3-phenylthiourea IUPAC Name: 1-[3-(benzenesulfonamido)propanoylamino]-3-phenylthiourea Traditional Name: 1-[3-(benzenesulfonamido)propanoylamino]-3-phenyl-thiourea Formula: C16H18N4O3S2 MolecularWeight: 378.46912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)CCNS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)CCNS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H18N4O3S2/c21-15(19-20-16(24)18-13-7-3-1-4-8-13)11-12-17-25(22,23)14-9-5-2-6-10-14/h1-10,17H,11-12H2,(H,19,21)(H2,18,20,24)