1-(3-methylbutanoylamino)-3-phenethyl-thiourea

Systemtic Name: 1-(3-methylbutanoylamino)-3-phenethyl-thiourea Openeye Name: 1-(3-methylbutanoylamino)-3-phenethyl-thiourea CAS Name: 1-[(3-methyl-1-oxobutyl)amino]-3-phenethylthiourea IUPAC Name: 1-(3-methylbutanoylamino)-3-phenethylthiourea Traditional Name: 1-(isovalerylamino)-3-phenethyl-thiourea Formula: C14H21N3OS MolecularWeight: 279.40104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNC(=S)NCCC1=CC=CC=C1

Isomeric SMILES

CC(C)CC(=O)NNC(=S)NCCC1=CC=CC=C1

InChI

InChI=1S/C14H21N3OS/c1-11(2)10-13(18)16-17-14(19)15-9-8-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H,16,18)(H2,15,17,19)