1-(4-butylphenyl)-3-[[(3S)-1-ethanoylpiperidin-3-yl]carbonylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[[(3S)-1-ethanoylpiperidin-3-yl]carbonylamino]thiourea Openeye Name: 1-[[(3S)-1-acetylpiperidine-3-carbonyl]amino]-3-(4-butylphenyl)thiourea CAS Name: 1-[[[(3S)-1-acetyl-3-piperidinyl]-oxomethyl]amino]-3-(4-butylphenyl)thiourea IUPAC Name: 1-[[(3S)-1-acetylpiperidine-3-carbonyl]amino]-3-(4-butylphenyl)thiourea Traditional Name: 1-[[(3S)-1-acetylnipecotoyl]amino]-3-(4-butylphenyl)thiourea Formula: C19H28N4O2S MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2CCCN(C2)C(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)[C@H]2CCCN(C2)C(=O)C

InChI

InChI=1S/C19H28N4O2S/c1-3-4-6-15-8-10-17(11-9-15)20-19(26)22-21-18(25)16-7-5-12-23(13-16)14(2)24/h8-11,16H,3-7,12-13H2,1-2H3,(H,21,25)(H2,20,22,26)/t16-/m0/s1