4-propan-2-yloxy-N-(1-pyrrolidin-3-ylpropyl)benzenecarbothioamide

Systemtic Name: 4-propan-2-yloxy-N-(1-pyrrolidin-3-ylpropyl)benzenecarbothioamide Openeye Name: 4-isopropoxy-N-(1-pyrrolidin-3-ylpropyl)benzenecarbothioamide CAS Name: 4-propan-2-yloxy-N-[1-(3-pyrrolidinyl)propyl]benzenecarbothioamide IUPAC Name: 4-propan-2-yloxy-N-(1-pyrrolidin-3-ylpropyl)benzenecarbothioamide Traditional Name: 4-isopropoxy-N-(1-pyrrolidin-3-ylpropyl)thiobenzamide Formula: C17H26N2OS MolecularWeight: 306.46614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCNC1)NC(=S)C2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CCC(C1CCNC1)NC(=S)C2=CC=C(C=C2)OC(C)C

InChI

InChI=1S/C17H26N2OS/c1-4-16(14-9-10-18-11-14)19-17(21)13-5-7-15(8-6-13)20-12(2)3/h5-8,12,14,16,18H,4,9-11H2,1-3H3,(H,19,21)