3-(5-chloranyl-2-methoxy-phenyl)-1-[(1-methylindol-3-yl)methyl]-1-(phenylmethyl)thiourea

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-1-[(1-methylindol-3-yl)methyl]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(5-chloro-2-methoxy-phenyl)-1-[(1-methylindol-3-yl)methyl]thiourea CAS Name: 3-(5-chloro-2-methoxyphenyl)-1-[(1-methyl-3-indolyl)methyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(5-chloro-2-methoxyphenyl)-1-[(1-methylindol-3-yl)methyl]thiourea Traditional Name: 1-benzyl-3-(5-chloro-2-methoxy-phenyl)-1-[(1-methylindol-3-yl)methyl]thiourea Formula: C25H24ClN3OS MolecularWeight: 449.99556

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CN(CC3=CC=CC=C3)C(=S)NC4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CN(CC3=CC=CC=C3)C(=S)NC4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C25H24ClN3OS/c1-28-16-19(21-10-6-7-11-23(21)28)17-29(15-18-8-4-3-5-9-18)25(31)27-22-14-20(26)12-13-24(22)30-2/h3-14,16H,15,17H2,1-2H3,(H,27,31)