1-(3,4-dihydro-1H-isochromen-1-ylmethyl)-3-phenyl-thiourea

Systemtic Name: 1-(3,4-dihydro-1H-isochromen-1-ylmethyl)-3-phenyl-thiourea Openeye Name: 1-(isochroman-1-ylmethyl)-3-phenyl-thiourea CAS Name: 1-(3,4-dihydro-1H-2-benzopyran-1-ylmethyl)-3-phenylthiourea IUPAC Name: 1-(3,4-dihydro-1H-isochromen-1-ylmethyl)-3-phenylthiourea Traditional Name: 1-(isochroman-1-ylmethyl)-3-phenyl-thiourea Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=CC=CC=C21)CNC(=S)NC3=CC=CC=C3

Isomeric SMILES

C1COC(C2=CC=CC=C21)CNC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C17H18N2OS/c21-17(19-14-7-2-1-3-8-14)18-12-16-15-9-5-4-6-13(15)10-11-20-16/h1-9,16H,10-12H2,(H2,18,19,21)