4-[1,1-bis(oxidanylidene)-3H-1,2-benzothiazol-2-yl]-N-(3,4-dihydro-2H-chromen-2-ylmethyl)butan-1-amine

Systemtic Name: 4-[1,1-bis(oxidanylidene)-3H-1,2-benzothiazol-2-yl]-N-(3,4-dihydro-2H-chromen-2-ylmethyl)butan-1-amine Openeye Name: N-(chroman-2-ylmethyl)-4-(1,1-dioxo-3H-1,2-benzothiazol-2-yl)butan-1-amine CAS Name: N-(3,4-dihydro-2H-1-benzopyran-2-ylmethyl)-4-(1,1-dioxo-3H-1,2-benzothiazol-2-yl)-1-butanamine IUPAC Name: N-(3,4-dihydro-2H-chromen-2-ylmethyl)-4-(1,1-dioxo-3H-1,2-benzothiazol-2-yl)butan-1-amine Traditional Name: chroman-2-ylmethyl-[4-(1,1-diketo-3H-1,2-benzothiazol-2-yl)butyl]amine Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2OC1CNCCCCN3CC4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1CC2=CC=CC=C2OC1CNCCCCN3CC4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C21H26N2O3S/c24-27(25)21-10-4-2-8-18(21)16-23(27)14-6-5-13-22-15-19-12-11-17-7-1-3-9-20(17)26-19/h1-4,7-10,19,22H,5-6,11-16H2