N-(2-azanylethyl)-1-(5-chloranylthiophen-2-yl)sulfonyl-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(5-chloranylthiophen-2-yl)sulfonyl-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-[(5-chloro-2-thienyl)sulfonyl]hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(5-chloro-2-thiophenyl)sulfonyl]-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-(5-chlorothiophen-2-yl)sulfonyl-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-[(5-chloro-2-thienyl)sulfonyl]hexahydropyrimidine-2-carboxamide Formula: C18H23ClN4O5S3 MolecularWeight: 507.04702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N(C1)S(=O)(=O)C2=CC=C(S2)Cl)C(=O)NCCN)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(C(N(C1)S(=O)(=O)C2=CC=C(S2)Cl)C(=O)NCCN)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H23ClN4O5S3/c19-15-7-8-16(29-15)31(27,28)23-12-4-11-22(18(23)17(24)21-10-9-20)30(25,26)13-14-5-2-1-3-6-14/h1-3,5-8,18H,4,9-13,20H2,(H,21,24)