2-(4-phenethyl-1,4-diazepan-1-yl)-1,3-benzothiazole

Systemtic Name: 2-(4-phenethyl-1,4-diazepan-1-yl)-1,3-benzothiazole Openeye Name: 2-(4-phenethyl-1,4-diazepan-1-yl)-1,3-benzothiazole CAS Name: 2-(4-phenethyl-1,4-diazepan-1-yl)-1,3-benzothiazole IUPAC Name: 2-(4-phenethyl-1,4-diazepan-1-yl)-1,3-benzothiazole Traditional Name: 2-(4-phenethyl-1,4-diazepan-1-yl)-1,3-benzothiazole Formula: C20H23N3S MolecularWeight: 337.48172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC3=CC=CC=C3S2)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C2=NC3=CC=CC=C3S2)CCC4=CC=CC=C4

InChI

InChI=1S/C20H23N3S/c1-2-7-17(8-3-1)11-14-22-12-6-13-23(16-15-22)20-21-18-9-4-5-10-19(18)24-20/h1-5,7-10H,6,11-16H2