4-[2-(3H-1,3-benzothiazol-2-ylidene)-7-bromanyl-5-chloranyl-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-7-bromanyl-5-chloranyl-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-7-bromo-5-chloro-indol-3-yl]butan-1-amine CAS Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-7-bromo-5-chloro-3-indolyl]-1-butanamine IUPAC Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-7-bromo-5-chloroindol-3-yl]butan-1-amine Traditional Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-7-bromo-5-chloro-indol-3-yl]butylamine Formula: C19H17BrClN3S MolecularWeight: 434.78038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C3C(=C4C=C(C=C(C4=N3)Br)Cl)CCCCN)S2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C3C(=C4C=C(C=C(C4=N3)Br)Cl)CCCCN)S2

InChI

InChI=1S/C19H17BrClN3S/c20-14-10-11(21)9-13-12(5-3-4-8-22)18(24-17(13)14)19-23-15-6-1-2-7-16(15)25-19/h1-2,6-7,9-10,23H,3-5,8,22H2