3-methyl-N-[4-(prop-2-enylcarbamothioylamino)phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-(prop-2-enylcarbamothioylamino)phenyl]butanamide Openeye Name: N-[4-(allylcarbamothioylamino)phenyl]-3-methyl-butanamide CAS Name: 3-methyl-N-[4-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-(prop-2-enylcarbamothioylamino)phenyl]butanamide Traditional Name: N-[4-(allylthiocarbamoylamino)phenyl]-3-methyl-butyramide Formula: C15H21N3OS MolecularWeight: 291.41174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=S)NCC=C

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=S)NCC=C

InChI

InChI=1S/C15H21N3OS/c1-4-9-16-15(20)18-13-7-5-12(6-8-13)17-14(19)10-11(2)3/h4-8,11H,1,9-10H2,2-3H3,(H,17,19)(H2,16,18,20)