1-[2-(2-ethylbenzimidazol-1-yl)ethanoylamino]-3-[(2S)-2-ethylhexyl]thiourea

Systemtic Name: 1-[2-(2-ethylbenzimidazol-1-yl)ethanoylamino]-3-[(2S)-2-ethylhexyl]thiourea Openeye Name: 1-[[2-(2-ethylbenzimidazol-1-yl)acetyl]amino]-3-[(2S)-2-ethylhexyl]thiourea CAS Name: 1-[[2-(2-ethyl-1-benzimidazolyl)-1-oxoethyl]amino]-3-[(2S)-2-ethylhexyl]thiourea IUPAC Name: 1-[[2-(2-ethylbenzimidazol-1-yl)acetyl]amino]-3-[(2S)-2-ethylhexyl]thiourea Traditional Name: 1-[[2-(2-ethylbenzimidazol-1-yl)acetyl]amino]-3-[(2S)-2-ethylhexyl]thiourea Formula: C20H31N5OS MolecularWeight: 389.55804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NNC(=O)CN1C2=CC=CC=C2N=C1CC

Isomeric SMILES

CCCC[C@H](CC)CNC(=S)NNC(=O)CN1C2=CC=CC=C2N=C1CC

InChI

InChI=1S/C20H31N5OS/c1-4-7-10-15(5-2)13-21-20(27)24-23-19(26)14-25-17-12-9-8-11-16(17)22-18(25)6-3/h8-9,11-12,15H,4-7,10,13-14H2,1-3H3,(H,23,26)(H2,21,24,27)/t15-/m0/s1