N-[1-(4-fluorophenyl)ethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepane-1-carbothioamide

Systemtic Name: N-[1-(4-fluorophenyl)ethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepane-1-carbothioamide Openeye Name: N-[1-(4-fluorophenyl)ethyl]-4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepane-1-carbothioamide CAS Name: N-[1-(4-fluorophenyl)ethyl]-4-[(2-methyl-4-thiazolyl)methyl]-1,4-diazepane-1-carbothioamide IUPAC Name: N-[1-(4-fluorophenyl)ethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepane-1-carbothioamide Traditional Name: N-[1-(4-fluorophenyl)ethyl]-4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepane-1-carbothioamide Formula: C19H25FN4S2 MolecularWeight: 392.557003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCCN(CC2)C(=S)NC(C)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NC(=CS1)CN2CCCN(CC2)C(=S)NC(C)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H25FN4S2/c1-14(16-4-6-17(20)7-5-16)21-19(25)24-9-3-8-23(10-11-24)12-18-13-26-15(2)22-18/h4-7,13-14H,3,8-12H2,1-2H3,(H,21,25)