3-butan-2-yl-1-(cyclohex-3-en-1-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-butan-2-yl-1-(cyclohex-3-en-1-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(3-pyridylmethyl)-3-sec-butyl-thiourea CAS Name: 3-butan-2-yl-1-(1-cyclohex-3-enylmethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-butan-2-yl-1-(cyclohex-3-en-1-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(3-pyridylmethyl)-3-sec-butyl-thiourea Formula: C18H27N3S MolecularWeight: 317.49208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=S)N(CC1CCC=CC1)CC2=CN=CC=C2

Isomeric SMILES

CCC(C)NC(=S)N(CC1CCC=CC1)CC2=CN=CC=C2

InChI

InChI=1S/C18H27N3S/c1-3-15(2)20-18(22)21(13-16-8-5-4-6-9-16)14-17-10-7-11-19-12-17/h4-5,7,10-12,15-16H,3,6,8-9,13-14H2,1-2H3,(H,20,22)