2-(1-methylimidazol-2-yl)sulfanyl-N-[4-[(propan-2-ylcarbamothioylamino)carbamoyl]phenyl]ethanamide

Systemtic Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[4-[(propan-2-ylcarbamothioylamino)carbamoyl]phenyl]ethanamide Openeye Name: N-[4-[(isopropylcarbamothioylamino)carbamoyl]phenyl]-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: 2-[(1-methyl-2-imidazolyl)thio]-N-[4-[oxo-[[(propan-2-ylamino)-sulfanylidenemethyl]hydrazo]methyl]phenyl]acetamide IUPAC Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[4-[(propan-2-ylcarbamothioylamino)carbamoyl]phenyl]acetamide Traditional Name: N-[4-[(isopropylthiocarbamoylamino)carbamoyl]phenyl]-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C17H22N6O2S2 MolecularWeight: 406.52558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=CN2C

Isomeric SMILES

CC(C)NC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=CN2C

InChI

InChI=1S/C17H22N6O2S2/c1-11(2)19-16(26)22-21-15(25)12-4-6-13(7-5-12)20-14(24)10-27-17-18-8-9-23(17)3/h4-9,11H,10H2,1-3H3,(H,20,24)(H,21,25)(H2,19,22,26)