1-[3-(3,4-dihydro-1H-isothiochromen-4-ylamino)phenyl]urea

Systemtic Name: 1-[3-(3,4-dihydro-1H-isothiochromen-4-ylamino)phenyl]urea Openeye Name: [3-(isothiochroman-4-ylamino)phenyl]urea CAS Name: [3-(3,4-dihydro-1H-2-benzothiopyran-4-ylamino)phenyl]urea IUPAC Name: [3-(3,4-dihydro-1H-isothiochromen-4-ylamino)phenyl]urea Traditional Name: [3-(isothiochroman-4-ylamino)phenyl]urea Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2CS1)NC3=CC=CC(=C3)NC(=O)N

Isomeric SMILES

C1C(C2=CC=CC=C2CS1)NC3=CC=CC(=C3)NC(=O)N

InChI

InChI=1S/C16H17N3OS/c17-16(20)19-13-6-3-5-12(8-13)18-15-10-21-9-11-4-1-2-7-14(11)15/h1-8,15,18H,9-10H2,(H3,17,19,20)