N-methyl-3-(pentanoylcarbamothioylamino)-N-(phenylmethyl)benzamide

Systemtic Name: N-methyl-3-(pentanoylcarbamothioylamino)-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-methyl-3-(pentanoylcarbamothioylamino)benzamide CAS Name: N-methyl-3-[[(1-oxopentylamino)-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-methyl-3-(pentanoylcarbamothioylamino)benzamide Traditional Name: N-benzyl-N-methyl-3-(valerylthiocarbamoylamino)benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)N(C)CC2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)N(C)CC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O2S/c1-3-4-13-19(25)23-21(27)22-18-12-8-11-17(14-18)20(26)24(2)15-16-9-6-5-7-10-16/h5-12,14H,3-4,13,15H2,1-2H3,(H2,22,23,25,27)