1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-fluorophenyl)thiourea

Systemtic Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-fluorophenyl)thiourea Openeye Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-fluorophenyl)thiourea CAS Name: 1-[4-(1-azepanylsulfonyl)phenyl]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-fluorophenyl)thiourea Traditional Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-fluorophenyl)thiourea Formula: C19H22FN3O2S2 MolecularWeight: 407.525283

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)F

InChI

InChI=1S/C19H22FN3O2S2/c20-15-5-7-16(8-6-15)21-19(26)22-17-9-11-18(12-10-17)27(24,25)23-13-3-1-2-4-14-23/h5-12H,1-4,13-14H2,(H2,21,22,26)