1-butyl-3-[3-(1-propan-2-ylpiperidin-4-yl)-1-benzofuran-5-yl]thiourea

Systemtic Name: 1-butyl-3-[3-(1-propan-2-ylpiperidin-4-yl)-1-benzofuran-5-yl]thiourea Openeye Name: 1-butyl-3-[3-(1-isopropyl-4-piperidyl)benzofuran-5-yl]thiourea CAS Name: 1-butyl-3-[3-(1-propan-2-yl-4-piperidinyl)-5-benzofuranyl]thiourea IUPAC Name: 1-butyl-3-[3-(1-propan-2-ylpiperidin-4-yl)-1-benzofuran-5-yl]thiourea Traditional Name: 1-butyl-3-[3-(1-isopropyl-4-piperidyl)benzofuran-5-yl]thiourea Formula: C21H31N3OS MolecularWeight: 373.55534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC2=C(C=C1)OC=C2C3CCN(CC3)C(C)C

Isomeric SMILES

CCCCNC(=S)NC1=CC2=C(C=C1)OC=C2C3CCN(CC3)C(C)C

InChI

InChI=1S/C21H31N3OS/c1-4-5-10-22-21(26)23-17-6-7-20-18(13-17)19(14-25-20)16-8-11-24(12-9-16)15(2)3/h6-7,13-16H,4-5,8-12H2,1-3H3,(H2,22,23,26)