4-(3-methylbutoxy)-N-(1-pyrrolidin-2-ylethyl)benzenecarbothioamide

Systemtic Name: 4-(3-methylbutoxy)-N-(1-pyrrolidin-2-ylethyl)benzenecarbothioamide Openeye Name: 4-isopentyloxy-N-(1-pyrrolidin-2-ylethyl)benzenecarbothioamide CAS Name: 4-(3-methylbutoxy)-N-[1-(2-pyrrolidinyl)ethyl]benzenecarbothioamide IUPAC Name: 4-(3-methylbutoxy)-N-(1-pyrrolidin-2-ylethyl)benzenecarbothioamide Traditional Name: 4-isoamoxy-N-(1-pyrrolidin-2-ylethyl)thiobenzamide Formula: C18H28N2OS MolecularWeight: 320.49272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=S)NC(C)C2CCCN2

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=S)NC(C)C2CCCN2

InChI

InChI=1S/C18H28N2OS/c1-13(2)10-12-21-16-8-6-15(7-9-16)18(22)20-14(3)17-5-4-11-19-17/h6-9,13-14,17,19H,4-5,10-12H2,1-3H3,(H,20,22)