1-(naphthalen-1-ylmethyl)-3-[naphthalen-1-ylsulfonyl(piperidin-4-yl)methyl]thiourea

Systemtic Name: 1-(naphthalen-1-ylmethyl)-3-[naphthalen-1-ylsulfonyl(piperidin-4-yl)methyl]thiourea Openeye Name: 1-(1-naphthylmethyl)-3-[1-naphthylsulfonyl(4-piperidyl)methyl]thiourea CAS Name: 1-(1-naphthalenylmethyl)-3-[1-naphthalenylsulfonyl(4-piperidinyl)methyl]thiourea IUPAC Name: 1-(naphthalen-1-ylmethyl)-3-[naphthalen-1-ylsulfonyl(piperidin-4-yl)methyl]thiourea Traditional Name: 1-(1-naphthylmethyl)-3-[1-naphthylsulfonyl(4-piperidyl)methyl]thiourea Formula: C28H29N3O2S2 MolecularWeight: 503.67876

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(NC(=S)NCC2=CC=CC3=CC=CC=C32)S(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CNCCC1C(NC(=S)NCC2=CC=CC3=CC=CC=C32)S(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H29N3O2S2/c32-35(33,26-14-6-10-21-8-2-4-13-25(21)26)27(22-15-17-29-18-16-22)31-28(34)30-19-23-11-5-9-20-7-1-3-12-24(20)23/h1-14,22,27,29H,15-19H2,(H2,30,31,34)