1-phenyl-3-[[4-[(phenylcarbamothioylamino)carbamoyl]phenyl]amino]thiourea

Systemtic Name: 1-phenyl-3-[[4-[(phenylcarbamothioylamino)carbamoyl]phenyl]amino]thiourea Openeye Name: 1-phenyl-3-[4-[(phenylcarbamothioylamino)carbamoyl]anilino]thiourea CAS Name: 1-[4-[[[anilino(sulfanylidene)methyl]hydrazo]-oxomethyl]anilino]-3-phenylthiourea IUPAC Name: 1-phenyl-3-[4-[(phenylcarbamothioylamino)carbamoyl]anilino]thiourea Traditional Name: 1-phenyl-3-[4-[(phenylthiocarbamoylamino)carbamoyl]anilino]thiourea Formula: C21H20N6OS2 MolecularWeight: 436.5531

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC2=CC=C(C=C2)C(=O)NNC(=S)NC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC2=CC=C(C=C2)C(=O)NNC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C21H20N6OS2/c28-19(25-27-21(30)23-17-9-5-2-6-10-17)15-11-13-18(14-12-15)24-26-20(29)22-16-7-3-1-4-8-16/h1-14,24H,(H,25,28)(H2,22,26,29)(H2,23,27,30)