[3-(cyclopropylcarbonylamino)-2-methoxycarbonyl-thieno[2,3-b]pyridin-6-yl]methyl-bis(prop-2-enyl)azanium

Systemtic Name: [3-(cyclopropylcarbonylamino)-2-methoxycarbonyl-thieno[2,3-b]pyridin-6-yl]methyl-bis(prop-2-enyl)azanium Openeye Name: diallyl-[[3-(cyclopropanecarbonylamino)-2-methoxycarbonyl-thieno[2,3-b]pyridin-6-yl]methyl]ammonium CAS Name: [3-[[cyclopropyl(oxo)methyl]amino]-2-methoxycarbonyl-6-thieno[2,3-b]pyridinyl]methyl-bis(prop-2-enyl)ammonium IUPAC Name: [3-(cyclopropanecarbonylamino)-2-methoxycarbonylthieno[2,3-b]pyridin-6-yl]methyl-bis(prop-2-enyl)azanium Traditional Name: diallyl-[[2-carbomethoxy-3-(cyclopropanecarbonylamino)thieno[2,3-b]pyridin-6-yl]methyl]ammonium Formula: C20H24N3O3S+ MolecularWeight: 386.48786

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)N=C(C=C2)C[NH+](CC=C)CC=C)NC(=O)C3CC3

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)N=C(C=C2)C[NH+](CC=C)CC=C)NC(=O)C3CC3

InChI

InChI=1S/C20H23N3O3S/c1-4-10-23(11-5-2)12-14-8-9-15-16(22-18(24)13-6-7-13)17(20(25)26-3)27-19(15)21-14/h4-5,8-9,13H,1-2,6-7,10-12H2,3H3,(H,22,24)/p+1