tert-butyl N-[3-[3-azanyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrazin-2-yl]propyl]carbamate

Systemtic Name: tert-butyl N-[3-[3-azanyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrazin-2-yl]propyl]carbamate Openeye Name: tert-butyl N-[3-[3-amino-6-[1-(p-tolylsulfonyl)indol-3-yl]pyrazin-2-yl]propyl]carbamate CAS Name: N-[3-[3-amino-6-[1-(4-methylphenyl)sulfonyl-3-indolyl]-2-pyrazinyl]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[3-amino-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrazin-2-yl]propyl]carbamate Traditional Name: N-[3-[3-amino-6-(1-tosylindol-3-yl)pyrazin-2-yl]propyl]carbamic acid tert-butyl ester Formula: C27H31N5O4S MolecularWeight: 521.63114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C4=CN=C(C(=N4)CCCNC(=O)OC(C)(C)C)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C4=CN=C(C(=N4)CCCNC(=O)OC(C)(C)C)N

InChI

InChI=1S/C27H31N5O4S/c1-18-11-13-19(14-12-18)37(34,35)32-17-21(20-8-5-6-10-24(20)32)23-16-30-25(28)22(31-23)9-7-15-29-26(33)36-27(2,3)4/h5-6,8,10-14,16-17H,7,9,15H2,1-4H3,(H2,28,30)(H,29,33)