1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3,4-dichlorophenyl)urea

Systemtic Name: 1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3,4-dichlorophenyl)urea Openeye Name: 1-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(3,4-dichlorophenyl)urea CAS Name: 1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3,4-dichlorophenyl)urea IUPAC Name: 1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3,4-dichlorophenyl)urea Traditional Name: 1-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(3,4-dichlorophenyl)urea Formula: C16H13Cl2N3OS MolecularWeight: 366.26492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)NC3=CC(=C(C=C3)Cl)Cl)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)NC3=CC(=C(C=C3)Cl)Cl)C#N

InChI

InChI=1S/C16H13Cl2N3OS/c17-12-6-5-9(7-13(12)18)20-16(22)21-15-11(8-19)10-3-1-2-4-14(10)23-15/h5-7H,1-4H2,(H2,20,21,22)