N-[(2-ethyl-4-iodanyl-phenyl)carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[(2-ethyl-4-iodanyl-phenyl)carbamothioyl]-3-methyl-butanamide Openeye Name: N-[(2-ethyl-4-iodo-phenyl)carbamothioyl]-3-methyl-butanamide CAS Name: N-[(2-ethyl-4-iodoanilino)-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[(2-ethyl-4-iodophenyl)carbamothioyl]-3-methylbutanamide Traditional Name: N-[(2-ethyl-4-iodo-phenyl)thiocarbamoyl]-3-methyl-butyramide Formula: C14H19IN2OS MolecularWeight: 390.28293

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)I)NC(=S)NC(=O)CC(C)C

Isomeric SMILES

CCC1=C(C=CC(=C1)I)NC(=S)NC(=O)CC(C)C

InChI

InChI=1S/C14H19IN2OS/c1-4-10-8-11(15)5-6-12(10)16-14(19)17-13(18)7-9(2)3/h5-6,8-9H,4,7H2,1-3H3,(H2,16,17,18,19)