1-[2-(azepan-1-yl)-5-chloranyl-phenyl]-3-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-[2-(azepan-1-yl)-5-chloranyl-phenyl]-3-(furan-2-ylmethyl)thiourea Openeye Name: 1-[2-(azepan-1-yl)-5-chloro-phenyl]-3-(2-furylmethyl)thiourea CAS Name: 1-[2-(1-azepanyl)-5-chlorophenyl]-3-(2-furanylmethyl)thiourea IUPAC Name: 1-[2-(azepan-1-yl)-5-chlorophenyl]-3-(furan-2-ylmethyl)thiourea Traditional Name: 1-[2-(azepan-1-yl)-5-chloro-phenyl]-3-(2-furfuryl)thiourea Formula: C18H22ClN3OS MolecularWeight: 363.90478

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)Cl)NC(=S)NCC3=CC=CO3

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)Cl)NC(=S)NCC3=CC=CO3

InChI

InChI=1S/C18H22ClN3OS/c19-14-7-8-17(22-9-3-1-2-4-10-22)16(12-14)21-18(24)20-13-15-6-5-11-23-15/h5-8,11-12H,1-4,9-10,13H2,(H2,20,21,24)