3-(5-chloranyl-2-methoxy-phenyl)-1,1-dipentyl-thiourea

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-1,1-dipentyl-thiourea Openeye Name: 3-(5-chloro-2-methoxy-phenyl)-1,1-dipentyl-thiourea CAS Name: 3-(5-chloro-2-methoxyphenyl)-1,1-dipentylthiourea IUPAC Name: 3-(5-chloro-2-methoxyphenyl)-1,1-dipentylthiourea Traditional Name: 1,1-diamyl-3-(5-chloro-2-methoxy-phenyl)thiourea Formula: C18H29ClN2OS MolecularWeight: 356.95366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=S)NC1=C(C=CC(=C1)Cl)OC

Isomeric SMILES

CCCCCN(CCCCC)C(=S)NC1=C(C=CC(=C1)Cl)OC

InChI

InChI=1S/C18H29ClN2OS/c1-4-6-8-12-21(13-9-7-5-2)18(23)20-16-14-15(19)10-11-17(16)22-3/h10-11,14H,4-9,12-13H2,1-3H3,(H,20,23)