2-azanyl-1-[5-(cyclopropylmethyl)-1,3-benzothiazol-2-yl]-4-phenyl-butan-1-ol

Systemtic Name: 2-azanyl-1-[5-(cyclopropylmethyl)-1,3-benzothiazol-2-yl]-4-phenyl-butan-1-ol Openeye Name: 2-amino-1-[5-(cyclopropylmethyl)-1,3-benzothiazol-2-yl]-4-phenyl-butan-1-ol CAS Name: 2-amino-1-[5-(cyclopropylmethyl)-1,3-benzothiazol-2-yl]-4-phenyl-1-butanol IUPAC Name: 2-amino-1-[5-(cyclopropylmethyl)-1,3-benzothiazol-2-yl]-4-phenylbutan-1-ol Traditional Name: 2-amino-1-[5-(cyclopropylmethyl)-1,3-benzothiazol-2-yl]-4-phenyl-butan-1-ol Formula: C21H24N2OS MolecularWeight: 352.49306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1CC2=CC3=C(C=C2)SC(=N3)C(C(CCC4=CC=CC=C4)N)O

Isomeric SMILES

C1CC1CC2=CC3=C(C=C2)SC(=N3)C(C(CCC4=CC=CC=C4)N)O

InChI

InChI=1S/C21H24N2OS/c22-17(10-8-14-4-2-1-3-5-14)20(24)21-23-18-13-16(12-15-6-7-15)9-11-19(18)25-21/h1-5,9,11,13,15,17,20,24H,6-8,10,12,22H2