1-[3-(1-butylpiperidin-4-yl)-2-methyl-1-benzothiophen-5-yl]-3-(3-iodanylphenyl)urea

Systemtic Name: 1-[3-(1-butylpiperidin-4-yl)-2-methyl-1-benzothiophen-5-yl]-3-(3-iodanylphenyl)urea Openeye Name: 1-[3-(1-butyl-4-piperidyl)-2-methyl-benzothiophen-5-yl]-3-(3-iodophenyl)urea CAS Name: 1-[3-(1-butyl-4-piperidinyl)-2-methyl-1-benzothiophen-5-yl]-3-(3-iodophenyl)urea IUPAC Name: 1-[3-(1-butylpiperidin-4-yl)-2-methyl-1-benzothiophen-5-yl]-3-(3-iodophenyl)urea Traditional Name: 1-[3-(1-butyl-4-piperidyl)-2-methyl-benzothiophen-5-yl]-3-(3-iodophenyl)urea Formula: C25H30IN3OS MolecularWeight: 547.49467

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)C2=C(SC3=C2C=C(C=C3)NC(=O)NC4=CC(=CC=C4)I)C

Isomeric SMILES

CCCCN1CCC(CC1)C2=C(SC3=C2C=C(C=C3)NC(=O)NC4=CC(=CC=C4)I)C

InChI

InChI=1S/C25H30IN3OS/c1-3-4-12-29-13-10-18(11-14-29)24-17(2)31-23-9-8-21(16-22(23)24)28-25(30)27-20-7-5-6-19(26)15-20/h5-9,15-16,18H,3-4,10-14H2,1-2H3,(H2,27,28,30)