1-butyl-3-phenyl-1-[(4-phenylphenyl)methyl]-3-pyridin-2-yl-urea; 1-chloranyl-2-(sulfinocarbamoyl)benzene

Systemtic Name: 1-butyl-3-phenyl-1-[(4-phenylphenyl)methyl]-3-pyridin-2-yl-urea; 1-chloranyl-2-(sulfinocarbamoyl)benzene Openeye Name: 1-butyl-3-phenyl-1-[(4-phenylphenyl)methyl]-3-(2-pyridyl)urea; 1-chloro-2-(sulfinocarbamoyl)benzene CAS Name: 1-butyl-3-phenyl-1-[(4-phenylphenyl)methyl]-3-(2-pyridinyl)urea; 1-chloro-2-[oxo-(sulfinoamino)methyl]benzene IUPAC Name: 1-butyl-3-phenyl-1-[(4-phenylphenyl)methyl]-3-pyridin-2-ylurea; 1-chloro-2-(sulfinocarbamoyl)benzene Traditional Name: 1-butyl-3-phenyl-1-(4-phenylbenzyl)-3-(2-pyridyl)urea; 1-chloro-2-(sulfinocarbamoyl)benzene Formula: C36H35ClN4O4S MolecularWeight: 655.2055

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)N(C3=CC=CC=C3)C4=CC=CC=N4.C1=CC=C(C(=C1)C(=O)NS(=O)O)Cl

Isomeric SMILES

CCCCN(CC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)N(C3=CC=CC=C3)C4=CC=CC=N4.C1=CC=C(C(=C1)C(=O)NS(=O)O)Cl

InChI

InChI=1S/C29H29N3O.C7H6ClNO3S/c1-2-3-22-31(23-24-17-19-26(20-18-24)25-12-6-4-7-13-25)29(33)32(27-14-8-5-9-15-27)28-16-10-11-21-30-28;8-6-4-2-1-3-5(6)7(10)9-13(11)12/h4-21H,2-3,22-23H2,1H3;1-4H,(H,9,10)(H,11,12)