N-[4-[(cyclopropylcarbonylcarbamothioylamino)carbamoyl]phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[(cyclopropylcarbonylcarbamothioylamino)carbamoyl]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[(cyclopropanecarbonylcarbamothioylamino)carbamoyl]phenyl]-2-methyl-benzamide CAS Name: N-[4-[[[[[cyclopropyl(oxo)methyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[(cyclopropanecarbonylcarbamothioylamino)carbamoyl]phenyl]-2-methylbenzamide Traditional Name: N-[4-[(cyclopropanecarbonylthiocarbamoylamino)carbamoyl]phenyl]-2-methyl-benzamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3CC3

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3CC3

InChI

InChI=1S/C20H20N4O3S/c1-12-4-2-3-5-16(12)19(27)21-15-10-8-14(9-11-15)18(26)23-24-20(28)22-17(25)13-6-7-13/h2-5,8-11,13H,6-7H2,1H3,(H,21,27)(H,23,26)(H2,22,24,25,28)