1-[[3-[(4-bromophenyl)sulfonylamino]phenyl]carbonylamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[[3-[(4-bromophenyl)sulfonylamino]phenyl]carbonylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[[3-[(4-bromophenyl)sulfonylamino]benzoyl]amino]thiourea CAS Name: 1-[[[3-[(4-bromophenyl)sulfonylamino]phenyl]-oxomethyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[[3-[(4-bromophenyl)sulfonylamino]benzoyl]amino]thiourea Traditional Name: 1-benzyl-3-[[3-(brosylamino)benzoyl]amino]thiourea Formula: C21H19BrN4O3S2 MolecularWeight: 519.43456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NNC(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H19BrN4O3S2/c22-17-9-11-19(12-10-17)31(28,29)26-18-8-4-7-16(13-18)20(27)24-25-21(30)23-14-15-5-2-1-3-6-15/h1-13,26H,14H2,(H,24,27)(H2,23,25,30)