methyl 2-[[8-[(2-fluorophenyl)carbamothioyl]-3,8-diazaspiro[4.5]decan-3-yl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[[8-[(2-fluorophenyl)carbamothioyl]-3,8-diazaspiro[4.5]decan-3-yl]carbonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[8-[(2-fluorophenyl)carbamothioyl]-3,8-diazaspiro[4.5]decane-3-carbonyl]amino]-4-methyl-pentanoate CAS Name: 2-[[[8-[(2-fluoroanilino)-sulfanylidenemethyl]-3,8-diazaspiro[4.5]decan-3-yl]-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[8-[(2-fluorophenyl)carbamothioyl]-3,8-diazaspiro[4.5]decane-3-carbonyl]amino]-4-methylpentanoate Traditional Name: 2-[[8-[(2-fluorophenyl)thiocarbamoyl]-3,8-diazaspiro[4.5]decane-3-carbonyl]amino]-4-methyl-valeric acid methyl ester Formula: C23H33FN4O3S MolecularWeight: 464.596523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)N1CCC2(C1)CCN(CC2)C(=S)NC3=CC=CC=C3F

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)N1CCC2(C1)CCN(CC2)C(=S)NC3=CC=CC=C3F

InChI

InChI=1S/C23H33FN4O3S/c1-16(2)14-19(20(29)31-3)25-21(30)28-13-10-23(15-28)8-11-27(12-9-23)22(32)26-18-7-5-4-6-17(18)24/h4-7,16,19H,8-15H2,1-3H3,(H,25,30)(H,26,32)