2-[(4-propan-2-ylphenyl)carbonylcarbamothioylamino]-N-prop-2-enyl-benzamide

Systemtic Name: 2-[(4-propan-2-ylphenyl)carbonylcarbamothioylamino]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-2-[(4-isopropylbenzoyl)carbamothioylamino]benzamide CAS Name: 2-[[[[oxo-(4-propan-2-ylphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-prop-2-enylbenzamide IUPAC Name: 2-[(4-propan-2-ylbenzoyl)carbamothioylamino]-N-prop-2-enylbenzamide Traditional Name: N-allyl-2-(cumoylthiocarbamoylamino)benzamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC=C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC=C

InChI

InChI=1S/C21H23N3O2S/c1-4-13-22-20(26)17-7-5-6-8-18(17)23-21(27)24-19(25)16-11-9-15(10-12-16)14(2)3/h4-12,14H,1,13H2,2-3H3,(H,22,26)(H2,23,24,25,27)