1-carbamimidoyl-1-(2-ethyl-6-methyl-phenyl)-3-(2-phenethyloxyethyl)thiourea

Systemtic Name: 1-carbamimidoyl-1-(2-ethyl-6-methyl-phenyl)-3-(2-phenethyloxyethyl)thiourea Openeye Name: 1-carbamimidoyl-1-(2-ethyl-6-methyl-phenyl)-3-(2-phenethyloxyethyl)thiourea CAS Name: 1-carbamimidoyl-1-(2-ethyl-6-methylphenyl)-3-(2-phenethyloxyethyl)thiourea IUPAC Name: 1-carbamimidoyl-1-(2-ethyl-6-methylphenyl)-3-(2-phenethyloxyethyl)thiourea Traditional Name: 1-amidino-1-(2-ethyl-6-methyl-phenyl)-3-(2-phenethyloxyethyl)thiourea Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1N(C(=N)N)C(=S)NCCOCCC2=CC=CC=C2)C

Isomeric SMILES

CCC1=CC=CC(=C1N(C(=N)N)C(=S)NCCOCCC2=CC=CC=C2)C

InChI

InChI=1S/C21H28N4OS/c1-3-18-11-7-8-16(2)19(18)25(20(22)23)21(27)24-13-15-26-14-12-17-9-5-4-6-10-17/h4-11H,3,12-15H2,1-2H3,(H3,22,23)(H,24,27)