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1-[2-(1-adamantyl)ethanoylamino]-3-(3-ethylphenyl)thiourea

1-[2-(1-adamantyl)ethanoylamino]-3-(3-ethylphenyl)thiourea

Systemtic Name:1-[2-(1-adamantyl)ethanoylamino]-3-(3-ethylphenyl)thiourea
Openeye Name:1-[[2-(1-adamantyl)acetyl]amino]-3-(3-ethylphenyl)thiourea
CAS Name:1-[[2-(1-adamantyl)-1-oxoethyl]amino]-3-(3-ethylphenyl)thiourea
IUPAC Name:1-[[2-(1-adamantyl)acetyl]amino]-3-(3-ethylphenyl)thiourea
Traditional Name:1-[[2-(1-adamantyl)acetyl]amino]-3-(3-ethylphenyl)thiourea
Formula: C21H29N3OS
MolecularWeight: 371.53946
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)NNC(=O)CC23CC4CC(C2)CC(C4)C3


Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)NNC(=O)CC23CC4CC(C2)CC(C4)C3


InChI

InChI=1S/C21H29N3OS/c1-2-14-4-3-5-18(9-14)22-20(26)24-23-19(25)13-21-10-15-6-16(11-21)8-17(7-15)12-21/h3-5,9,15-17H,2,6-8,10-13H2,1H3,(H,23,25)(H2,22,24,26)


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