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

Systemtic Name: 1-butyl-3-[[4-[(butylcarbamothioylamino)carbamoyl]phenyl]amino]thiourea Openeye Name: 1-butyl-3-[4-[(butylcarbamothioylamino)carbamoyl]anilino]thiourea CAS Name: 1-butyl-3-[4-[[[butylamino(sulfanylidene)methyl]hydrazo]-oxomethyl]anilino]thiourea IUPAC Name: 1-butyl-3-[4-[(butylcarbamothioylamino)carbamoyl]anilino]thiourea Traditional Name: 1-butyl-3-[4-[(butylthiocarbamoylamino)carbamoyl]anilino]thiourea Formula: C17H28N6OS2 MolecularWeight: 396.57382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC1=CC=C(C=C1)C(=O)NNC(=S)NCCCC

Isomeric SMILES

CCCCNC(=S)NNC1=CC=C(C=C1)C(=O)NNC(=S)NCCCC

InChI

InChI=1S/C17H28N6OS2/c1-3-5-11-18-16(25)22-20-14-9-7-13(8-10-14)15(24)21-23-17(26)19-12-6-4-2/h7-10,20H,3-6,11-12H2,1-2H3,(H,21,24)(H2,18,22,25)(H2,19,23,26)