1-pentan-3-yl-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-pentan-3-yl-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-(1-ethylpropyl)-3-(4-phenoxyphenyl)thiourea CAS Name: 1-pentan-3-yl-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-pentan-3-yl-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-(1-ethylpropyl)-3-(4-phenoxyphenyl)thiourea Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=S)NC1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

CCC(CC)NC(=S)NC1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C18H22N2OS/c1-3-14(4-2)19-18(22)20-15-10-12-17(13-11-15)21-16-8-6-5-7-9-16/h5-14H,3-4H2,1-2H3,(H2,19,20,22)