(2R)-2-[(4-butylphenyl)carbamothioylamino]-N-propyl-propanamide

Systemtic Name: (2R)-2-[(4-butylphenyl)carbamothioylamino]-N-propyl-propanamide Openeye Name: (2R)-2-[(4-butylphenyl)carbamothioylamino]-N-propyl-propanamide CAS Name: (2R)-2-[[(4-butylanilino)-sulfanylidenemethyl]amino]-N-propylpropanamide IUPAC Name: (2R)-2-[(4-butylphenyl)carbamothioylamino]-N-propylpropanamide Traditional Name: (2R)-2-[(4-butylphenyl)thiocarbamoylamino]-N-propyl-propionamide Formula: C17H27N3OS MolecularWeight: 321.48078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC(C)C(=O)NCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N[C@H](C)C(=O)NCCC

InChI

InChI=1S/C17H27N3OS/c1-4-6-7-14-8-10-15(11-9-14)20-17(22)19-13(3)16(21)18-12-5-2/h8-11,13H,4-7,12H2,1-3H3,(H,18,21)(H2,19,20,22)/t13-/m1/s1