1-dodecyl-3-(2-phenylethanoylamino)thiourea

Systemtic Name: 1-dodecyl-3-(2-phenylethanoylamino)thiourea Openeye Name: 1-dodecyl-3-[(2-phenylacetyl)amino]thiourea CAS Name: 1-dodecyl-3-[(1-oxo-2-phenylethyl)amino]thiourea IUPAC Name: 1-dodecyl-3-[(2-phenylacetyl)amino]thiourea Traditional Name: 1-lauryl-3-[(2-phenylacetyl)amino]thiourea Formula: C21H35N3OS MolecularWeight: 377.5871

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=S)NNC(=O)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCNC(=S)NNC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C21H35N3OS/c1-2-3-4-5-6-7-8-9-10-14-17-22-21(26)24-23-20(25)18-19-15-12-11-13-16-19/h11-13,15-16H,2-10,14,17-18H2,1H3,(H,23,25)(H2,22,24,26)