1-[[(1S)-cyclohex-3-en-1-yl]methyl]-3-pentyl-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-3-pentyl-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-3-pentyl-1-(3-pyridylmethyl)thiourea CAS Name: 1-[[(1S)-1-cyclohex-3-enyl]methyl]-3-pentyl-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-3-pentyl-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-amyl-1-[[(1S)-cyclohex-3-en-1-yl]methyl]-1-(3-pyridylmethyl)thiourea Formula: C19H29N3S MolecularWeight: 331.51866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)N(CC1CCC=CC1)CC2=CN=CC=C2

Isomeric SMILES

CCCCCNC(=S)N(C[C@H]1CCC=CC1)CC2=CN=CC=C2

InChI

InChI=1S/C19H29N3S/c1-2-3-7-13-21-19(23)22(15-17-9-5-4-6-10-17)16-18-11-8-12-20-14-18/h4-5,8,11-12,14,17H,2-3,6-7,9-10,13,15-16H2,1H3,(H,21,23)/t17-/m1/s1