N-[4-[(cyclopropylcarbonylcarbamothioylamino)carbamoyl]phenyl]-3-methyl-benzamide

Systemtic Name: N-[4-[(cyclopropylcarbonylcarbamothioylamino)carbamoyl]phenyl]-3-methyl-benzamide Openeye Name: N-[4-[(cyclopropanecarbonylcarbamothioylamino)carbamoyl]phenyl]-3-methyl-benzamide CAS Name: N-[4-[[[[[cyclopropyl(oxo)methyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-3-methylbenzamide IUPAC Name: N-[4-[(cyclopropanecarbonylcarbamothioylamino)carbamoyl]phenyl]-3-methylbenzamide Traditional Name: N-[4-[(cyclopropanecarbonylthiocarbamoylamino)carbamoyl]phenyl]-3-methyl-benzamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3CC3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3CC3

InChI

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