N-butyl-5-[4-[methyl(prop-2-enyl)amino]butoxy]-2,3-dihydroindole-1-carbothioamide

Systemtic Name: N-butyl-5-[4-[methyl(prop-2-enyl)amino]butoxy]-2,3-dihydroindole-1-carbothioamide Openeye Name: 5-[4-[allyl(methyl)amino]butoxy]-N-butyl-indoline-1-carbothioamide CAS Name: N-butyl-5-[4-[methyl(prop-2-enyl)amino]butoxy]-2,3-dihydroindole-1-carbothioamide IUPAC Name: N-butyl-5-[4-[methyl(prop-2-enyl)amino]butoxy]-2,3-dihydroindole-1-carbothioamide Traditional Name: 5-[4-[allyl(methyl)amino]butoxy]-N-butyl-indoline-1-carbothioamide Formula: C21H33N3OS MolecularWeight: 375.57122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CCC2=C1C=CC(=C2)OCCCCN(C)CC=C

Isomeric SMILES

CCCCNC(=S)N1CCC2=C1C=CC(=C2)OCCCCN(C)CC=C

InChI

InChI=1S/C21H33N3OS/c1-4-6-12-22-21(26)24-15-11-18-17-19(9-10-20(18)24)25-16-8-7-14-23(3)13-5-2/h5,9-10,17H,2,4,6-8,11-16H2,1,3H3,(H,22,26)