1-(1,3-benzodioxol-5-yl)-3-(1-phenylethyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(1-phenylethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(1-phenylethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(1-phenylethyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(1-phenylethyl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(1-phenylethyl)thiourea Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H16N2O2S/c1-11(12-5-3-2-4-6-12)17-16(21)18-13-7-8-14-15(9-13)20-10-19-14/h2-9,11H,10H2,1H3,(H2,17,18,21)