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1-[(1R)-1-(1-adamantyl)butyl]-3-(1,3-benzodioxol-5-yl)thiourea

1-[(1R)-1-(1-adamantyl)butyl]-3-(1,3-benzodioxol-5-yl)thiourea

Systemtic Name:1-[(1R)-1-(1-adamantyl)butyl]-3-(1,3-benzodioxol-5-yl)thiourea
Openeye Name:1-[(1R)-1-(1-adamantyl)butyl]-3-(1,3-benzodioxol-5-yl)thiourea
CAS Name:1-[(1R)-1-(1-adamantyl)butyl]-3-(1,3-benzodioxol-5-yl)thiourea
IUPAC Name:1-[(1R)-1-(1-adamantyl)butyl]-3-(1,3-benzodioxol-5-yl)thiourea
Traditional Name:1-[(1R)-1-(1-adamantyl)butyl]-3-(1,3-benzodioxol-5-yl)thiourea
Formula: C22H30N2O2S
MolecularWeight: 386.5508
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=CC5=C(C=C4)OCO5


Isomeric SMILES

CCC[C@H](C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=CC5=C(C=C4)OCO5


InChI

InChI=1S/C22H30N2O2S/c1-2-3-20(22-10-14-6-15(11-22)8-16(7-14)12-22)24-21(27)23-17-4-5-18-19(9-17)26-13-25-18/h4-5,9,14-16,20H,2-3,6-8,10-13H2,1H3,(H2,23,24,27)/t14?,15?,16?,20-,22?/m1/s1


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