6-chloranyl-N-(phenylmethyl)-2-piperazin-1-yl-4-thiomorpholin-4-yl-pteridin-7-amine

Systemtic Name: 6-chloranyl-N-(phenylmethyl)-2-piperazin-1-yl-4-thiomorpholin-4-yl-pteridin-7-amine Openeye Name: N-benzyl-6-chloro-2-piperazin-1-yl-4-thiomorpholino-pteridin-7-amine CAS Name: 6-chloro-N-(phenylmethyl)-2-(1-piperazinyl)-4-thiomorpholin-4-yl-7-pteridinamine IUPAC Name: N-benzyl-6-chloro-2-piperazin-1-yl-4-thiomorpholin-4-ylpteridin-7-amine Traditional Name: benzyl-(6-chloro-2-piperazino-4-thiomorpholino-pteridin-7-yl)amine Formula: C21H25ClN8S MolecularWeight: 456.9948

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=C(C(=N2)N4CCSCC4)N=C(C(=N3)NCC5=CC=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1)C2=NC3=C(C(=N2)N4CCSCC4)N=C(C(=N3)NCC5=CC=CC=C5)Cl

InChI

InChI=1S/C21H25ClN8S/c22-17-19(24-14-15-4-2-1-3-5-15)26-18-16(25-17)20(29-10-12-31-13-11-29)28-21(27-18)30-8-6-23-7-9-30/h1-5,23H,6-14H2,(H,24,26,27,28)