1-[2,5-bis(chloranyl)phenyl]-3-[(Z)-1H-isothiochromen-4-ylideneamino]thiourea

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]-3-[(Z)-1H-isothiochromen-4-ylideneamino]thiourea Openeye Name: 1-(2,5-dichlorophenyl)-3-[(Z)-isothiochroman-4-ylideneamino]thiourea CAS Name: 1-[(Z)-1H-2-benzothiopyran-4-ylideneamino]-3-(2,5-dichlorophenyl)thiourea IUPAC Name: 1-(2,5-dichlorophenyl)-3-[(Z)-1H-isothiochromen-4-ylideneamino]thiourea Traditional Name: 1-(2,5-dichlorophenyl)-3-[(Z)-isothiochroman-4-ylideneamino]thiourea Formula: C16H13Cl2N3S2 MolecularWeight: 382.33052

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NNC(=S)NC3=C(C=CC(=C3)Cl)Cl)CS1

Isomeric SMILES

C1C2=CC=CC=C2/C(=N/NC(=S)NC3=C(C=CC(=C3)Cl)Cl)/CS1

InChI

InChI=1S/C16H13Cl2N3S2/c17-11-5-6-13(18)14(7-11)19-16(22)21-20-15-9-23-8-10-3-1-2-4-12(10)15/h1-7H,8-9H2,(H2,19,21,22)/b20-15+