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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NNC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NNC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

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