N-(4-iodanyl-2-propan-2-yl-phenyl)-9-thia-7-azaspiro[4.4]non-7-en-8-amine

Systemtic Name: N-(4-iodanyl-2-propan-2-yl-phenyl)-9-thia-7-azaspiro[4.4]non-7-en-8-amine Openeye Name: N-(4-iodo-2-isopropyl-phenyl)-9-thia-7-azaspiro[4.4]non-7-en-8-amine CAS Name: N-(4-iodo-2-propan-2-ylphenyl)-9-thia-7-azaspiro[4.4]non-7-en-8-amine IUPAC Name: N-(4-iodo-2-propan-2-ylphenyl)-9-thia-7-azaspiro[4.4]non-7-en-8-amine Traditional Name: (4-iodo-2-isopropyl-phenyl)-(9-thia-7-azaspiro[4.4]non-7-en-8-yl)amine Formula: C16H21IN2S MolecularWeight: 400.32081

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)I)NC2=NCC3(S2)CCCC3

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)I)NC2=NCC3(S2)CCCC3

InChI

InChI=1S/C16H21IN2S/c1-11(2)13-9-12(17)5-6-14(13)19-15-18-10-16(20-15)7-3-4-8-16/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H,18,19)