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

Systemtic Name: 1-butyl-3-[3-[(butylcarbamothioylamino)carbamoyl]phenyl]thiourea Openeye Name: 1-butyl-3-[[3-(butylcarbamothioylamino)benzoyl]amino]thiourea CAS Name: 1-butyl-3-[[[3-[[butylamino(sulfanylidene)methyl]amino]phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-butyl-3-[[3-(butylcarbamothioylamino)benzoyl]amino]thiourea Traditional Name: 1-butyl-3-[[3-(butylthiocarbamoylamino)benzoyl]amino]thiourea Formula: C17H27N5OS2 MolecularWeight: 381.55918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC=CC(=C1)C(=O)NNC(=S)NCCCC

Isomeric SMILES

CCCCNC(=S)NC1=CC=CC(=C1)C(=O)NNC(=S)NCCCC

InChI

InChI=1S/C17H27N5OS2/c1-3-5-10-18-16(24)20-14-9-7-8-13(12-14)15(23)21-22-17(25)19-11-6-4-2/h7-9,12H,3-6,10-11H2,1-2H3,(H,21,23)(H2,18,20,24)(H2,19,22,25)