1-[2-[5,6-bis(chloranyl)-2-piperidin-4-yl-benzimidazol-1-yl]ethanoylamino]-3-phenyl-thiourea

Systemtic Name: 1-[2-[5,6-bis(chloranyl)-2-piperidin-4-yl-benzimidazol-1-yl]ethanoylamino]-3-phenyl-thiourea Openeye Name: 1-[[2-[5,6-dichloro-2-(4-piperidyl)benzimidazol-1-yl]acetyl]amino]-3-phenyl-thiourea CAS Name: 1-[[2-[5,6-dichloro-2-(4-piperidinyl)-1-benzimidazolyl]-1-oxoethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-(5,6-dichloro-2-piperidin-4-ylbenzimidazol-1-yl)acetyl]amino]-3-phenylthiourea Traditional Name: 1-[[2-[5,6-dichloro-2-(4-piperidyl)benzimidazol-1-yl]acetyl]amino]-3-phenyl-thiourea Formula: C21H22Cl2N6OS MolecularWeight: 477.40998

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=NC3=CC(=C(C=C3N2CC(=O)NNC(=S)NC4=CC=CC=C4)Cl)Cl

Isomeric SMILES

C1CNCCC1C2=NC3=CC(=C(C=C3N2CC(=O)NNC(=S)NC4=CC=CC=C4)Cl)Cl

InChI

InChI=1S/C21H22Cl2N6OS/c22-15-10-17-18(11-16(15)23)29(20(26-17)13-6-8-24-9-7-13)12-19(30)27-28-21(31)25-14-4-2-1-3-5-14/h1-5,10-11,13,24H,6-9,12H2,(H,27,30)(H2,25,28,31)