1-[3,5-bis(chloranyl)-4-(4-cyanophenyl)sulfanyl-phenyl]-3-propyl-urea

Systemtic Name: 1-[3,5-bis(chloranyl)-4-(4-cyanophenyl)sulfanyl-phenyl]-3-propyl-urea Openeye Name: 1-[3,5-dichloro-4-(4-cyanophenyl)sulfanyl-phenyl]-3-propyl-urea CAS Name: 1-[3,5-dichloro-4-[(4-cyanophenyl)thio]phenyl]-3-propylurea IUPAC Name: 1-[3,5-dichloro-4-(4-cyanophenyl)sulfanylphenyl]-3-propylurea Traditional Name: 1-[3,5-dichloro-4-[(4-cyanophenyl)thio]phenyl]-3-propyl-urea Formula: C17H15Cl2N3OS MolecularWeight: 380.2915

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC1=CC(=C(C(=C1)Cl)SC2=CC=C(C=C2)C#N)Cl

Isomeric SMILES

CCCNC(=O)NC1=CC(=C(C(=C1)Cl)SC2=CC=C(C=C2)C#N)Cl

InChI

InChI=1S/C17H15Cl2N3OS/c1-2-7-21-17(23)22-12-8-14(18)16(15(19)9-12)24-13-5-3-11(10-20)4-6-13/h3-6,8-9H,2,7H2,1H3,(H2,21,22,23)